Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fgg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ARG 31.A O no hydrogen 2.965 N/A TYR 4.A N VAL 104.A O no hydrogen 2.796 N/A VAL 5.A N HIS 33.A O no hydrogen 3.059 N/A VAL 6.A N TYR 106.A O no hydrogen 2.708 N/A THR 7.A N LEU 35.A O no hydrogen 3.057 N/A THR 7.A OG1 ALA 108.A O no hydrogen 2.768 N/A THR 9.A N VAL 37.A O no hydrogen 2.959 N/A THR 9.A OG1 ASP 110.A OD2 no hydrogen 2.816 N/A ARG 12.A NH1 TYR 10.A O no hydrogen 2.878 N/A ARG 12.A NH1 ASP 110.A OD2 no hydrogen 2.839 N/A ARG 12.A NH2 ASP 110.A OD1 no hydrogen 2.939 N/A ARG 12.A NH2 ASP 110.A OD2 no hydrogen 3.241 N/A GLN 15.A N ARG 12.A O no hydrogen 3.076 N/A GLN 15.A NE2 THR 9.A OG1 no hydrogen 3.001 N/A LYS 16.A NZ GLU 249.A OE1 no hydrogen 2.710 N/A GLU 18.A N VAL 14.A O no hydrogen 2.933 N/A LEU 19.A N GLN 15.A O no hydrogen 2.878 N/A VAL 20.A N LYS 16.A O no hydrogen 2.783 N/A ARG 21.A N ALA 17.A O no hydrogen 3.174 N/A ARG 21.A NE GLU 18.A OE1 no hydrogen 3.071 N/A ARG 21.A NH2 GLU 18.A OE1 no hydrogen 2.826 N/A LEU 22.A N GLU 18.A O no hydrogen 3.080 N/A SER 23.A N LEU 19.A O no hydrogen 2.782 N/A SER 23.A OG LEU 19.A O no hydrogen 2.580 N/A SER 23.A OG VAL 20.A O no hydrogen 3.026 N/A GLN 24.A N VAL 20.A O no hydrogen 2.892 N/A THR 25.A N ARG 21.A O no hydrogen 3.026 N/A THR 25.A OG1 ARG 21.A O no hydrogen 3.328 N/A LEU 26.A N LEU 22.A O no hydrogen 2.853 N/A SER 27.A N SER 23.A O no hydrogen 3.029 N/A SER 27.A OG GLN 24.A O no hydrogen 2.712 N/A LEU 28.A N THR 25.A O no hydrogen 3.120 N/A VAL 29.A N LEU 26.A O no hydrogen 3.145 N/A HIS 33.A N ILE 3.A O no hydrogen 2.848 N/A HIS 33.A NE2 THR 59.A OG1 no hydrogen 2.574 N/A TRP 34.A N LEU 57.A O no hydrogen 2.952 N/A TRP 34.A NE1 THR 7.A OG1 no hydrogen 2.893 N/A LEU 35.A N VAL 5.A O no hydrogen 2.855 N/A LEU 36.A N THR 59.A O no hydrogen 3.209 N/A VAL 37.A N THR 7.A O no hydrogen 2.978 N/A GLU 38.A N LEU 61.A O no hydrogen 2.876 N/A ASP 39.A N THR 9.A O no hydrogen 2.781 N/A THR 44.A N GLU 38.A OE2 no hydrogen 3.083 N/A THR 44.A OG1 GLU 38.A OE1 no hydrogen 2.702 N/A VAL 47.A N THR 44.A OG1 no hydrogen 3.345 N/A SER 48.A N THR 44.A O no hydrogen 2.989 N/A SER 48.A OG THR 44.A O no hydrogen 3.041 N/A GLY 49.A N PRO 45.A O no hydrogen 2.799 N/A LEU 50.A N LEU 46.A O no hydrogen 3.035 N/A LEU 51.A N VAL 47.A O no hydrogen 2.953 N/A ALA 52.A N SER 48.A O no hydrogen 3.069 N/A ALA 53.A N GLY 49.A O no hydrogen 3.144 N/A SER 54.A N LEU 51.A O no hydrogen 3.040 N/A SER 54.A OG LEU 51.A O no hydrogen 2.796 N/A LEU 56.A N SER 54.A OG no hydrogen 2.969 N/A THR 59.A N TRP 34.A O no hydrogen 2.987 N/A THR 59.A OG1 HIS 33.A NE2 no hydrogen 2.574 N/A THR 59.A OG1 GLU 93.A O no hydrogen 2.832 N/A HIS 60.A N GLY 91.A O no hydrogen 2.896 N/A HIS 60.A NE2 GLU 38.A OE2 no hydrogen 2.587 N/A LEU 61.A N LEU 36.A O no hydrogen 2.831 N/A VAL 63.A N GLU 38.A O no hydrogen 3.070 N/A THR 65.A N ASP 39.A OD1 no hydrogen 3.041 N/A THR 65.A OG1 ASP 39.A OD2 no hydrogen 2.531 N/A THR 65.A OG1 GLU 74.A OE1 no hydrogen 3.204 N/A GLN 75.A NE2 VAL 63.A O no hydrogen 3.222 N/A GLN 75.A NE2 THR 65.A OG1 no hydrogen 2.772 N/A ARG 76.A N GLY 72.A O no hydrogen 2.871 N/A ARG 76.A NH1 ARG 71.A O no hydrogen 2.891 N/A ARG 76.A NH2 ARG 71.A O no hydrogen 3.325 N/A ARG 76.A NH2 ASP 109.A OD2 no hydrogen 2.758 N/A ASN 77.A N VAL 73.A O no hydrogen 2.916 N/A ASN 77.A ND2 PHE 186.A O no hydrogen 3.035 N/A LYS 78.A N GLU 74.A O no hydrogen 2.866 N/A ALA 79.A N GLN 75.A O no hydrogen 3.185 N/A LEU 80.A N ARG 76.A O no hydrogen 3.101 N/A ASP 81.A N ASN 77.A O no hydrogen 2.807 N/A TRP 82.A N LYS 78.A O no hydrogen 2.981 N/A TRP 82.A NE1 LYS 94.A O no hydrogen 2.981 N/A LEU 83.A N ALA 79.A O no hydrogen 3.021 N/A ARG 84.A N LEU 80.A O no hydrogen 3.007 N/A ARG 84.A N ASP 81.A O no hydrogen 2.982 N/A ARG 84.A NH1 ALA 184.A O no hydrogen 2.935 N/A ARG 84.A NH2 LEU 178.A O no hydrogen 2.892 N/A ARG 84.A NH2 ALA 184.A O no hydrogen 2.935 N/A GLY 85.A N TRP 82.A O no hydrogen 3.012 N/A ARG 86.A N ASP 81.A O no hydrogen 3.024 N/A ARG 86.A NH1 ASP 81.A OD1 no hydrogen 2.978 N/A VAL 90.A N HIS 60.A O no hydrogen 3.002 N/A GLU 93.A N PHE 58.A O no hydrogen 2.893 N/A THR 101.A N PRO 98.A O no hydrogen 3.275 N/A THR 101.A OG1 PRO 98.A O no hydrogen 2.650 N/A VAL 104.A N THR 2.A O no hydrogen 3.119 N/A VAL 105.A N VAL 173.A O no hydrogen 2.658 N/A TYR 106.A N TYR 4.A O no hydrogen 2.862 N/A TYR 106.A OH ALA 169.A O no hydrogen 2.869 N/A ALA 108.A N VAL 6.A O no hydrogen 2.874 N/A ASN 112.A ND2 TYR 114.A OH no hydrogen 3.164 N/A THR 113.A N TRP 222.A O no hydrogen 2.907 N/A THR 113.A OG1 THR 224.A OG1 no hydrogen 2.856 N/A TYR 114.A OH ASP 109.A O no hydrogen 2.740 N/A SER 115.A N LEU 220.A O no hydrogen 3.185 N/A SER 115.A OG LEU 220.A O no hydrogen 2.869 N/A LEU 118.A N SER 115.A O no hydrogen 3.069 N/A PHE 119.A N ARG 116.A O no hydrogen 3.173 N/A GLU 120.A N GLU 117.A O no hydrogen 3.154 N/A GLU 121.A N GLU 117.A O no hydrogen 3.350 N/A GLU 121.A N LEU 118.A O no hydrogen 3.050 N/A MET 122.A N LEU 118.A O no hydrogen 3.283 N/A ARG 123.A N PHE 119.A O no hydrogen 3.171 N/A ARG 123.A NE GLU 120.A OE2 no hydrogen 2.972 N/A ARG 123.A NH1 MET 1.A O no hydrogen 2.785 N/A ARG 123.A NH1 PRO 30.A O no hydrogen 3.176 N/A ARG 123.A NH1 ARG 31.A O no hydrogen 3.310 N/A ARG 123.A NH2 PRO 30.A O no hydrogen 2.836 N/A ARG 123.A NH2 GLU 120.A OE1 no hydrogen 2.886 N/A THR 125.A N MET 122.A O no hydrogen 3.259 N/A THR 125.A OG1 MET 122.A O no hydrogen 2.562 N/A THR 125.A OG1 SER 129.A OG no hydrogen 2.704 N/A ARG 126.A N GLU 210.A OE1 no hydrogen 2.931 N/A GLY 127.A N GLU 210.A OE2 no hydrogen 2.762 N/A SER 129.A N ALA 172.A O no hydrogen 3.119 N/A SER 129.A OG THR 125.A OG1 no hydrogen 2.704 N/A VAL 130.A N GLU 210.A O no hydrogen 2.905 N/A TRP 131.A N GLY 170.A O no hydrogen 3.334 N/A TRP 131.A NE1 ALA 169.A O no hydrogen 2.960 N/A VAL 133.A N GLU 142.A O no hydrogen 2.768 N/A GLY 134.A N VAL 221.A O no hydrogen 3.047 N/A LEU 135.A N ARG 140.A O no hydrogen 2.596 N/A LEU 139.A N VAL 136.A O no hydrogen 2.948 N/A GLU 142.A N VAL 133.A O no hydrogen 2.844 N/A GLY 143.A N HIS 155.A O no hydrogen 3.123 N/A GLN 145.A N GLY 153.A O no hydrogen 2.924 N/A GLN 147.A N ARG 150.A O no hydrogen 2.843 N/A ARG 150.A N GLN 147.A O no hydrogen 3.020 N/A ARG 150.A NH2 LYS 207.A O no hydrogen 3.086 N/A VAL 152.A N GLN 145.A O no hydrogen 2.979 N/A HIS 155.A N GLY 143.A O no hydrogen 2.700 N/A THR 156.A OG1 GLU 142.A OE2 no hydrogen 2.989 N/A SER 161.A OG GLU 159.A OE2 no hydrogen 3.551 N/A ARG 162.A N GLU 159.A O no hydrogen 3.152 N/A ARG 162.A NE GLU 159.A O no hydrogen 3.026 N/A ARG 162.A NH2 GLU 142.A OE2 no hydrogen 3.129 N/A ARG 162.A NH2 TRP 158.A O no hydrogen 3.213 N/A PHE 164.A N SER 197.A OG no hydrogen 3.032 N/A VAL 166.A N PHE 164.A O no hydrogen 2.700 N/A ALA 169.A N ASP 167.A OD1 no hydrogen 3.008 N/A GLY 170.A N ASP 167.A O no hydrogen 2.666 N/A ALA 172.A N SER 129.A O no hydrogen 3.216 N/A VAL 173.A N VAL 105.A O no hydrogen 2.828 N/A ALA 174.A N GLY 127.A O no hydrogen 2.793 N/A LEU 175.A N GLY 103.A O no hydrogen 2.907 N/A LEU 178.A N ALA 174.A O no hydrogen 3.181 N/A LEU 179.A N LEU 175.A O no hydrogen 3.154 N/A ASP 180.A N PRO 176.A O no hydrogen 3.032 N/A LYS 181.A N LEU 178.A O no hydrogen 3.251 N/A ALA 184.A N LYS 181.A O no hydrogen 2.958 N/A PHE 186.A N ASN 77.A OD1 no hydrogen 2.968 N/A ASP 187.A N SER 198.A OG no hydrogen 2.911 N/A THR 189.A N ASP 187.A OD1 no hydrogen 2.756 N/A THR 189.A OG1 ASP 187.A OD1 no hydrogen 2.602 N/A THR 189.A OG1 ASP 187.A OD2 no hydrogen 3.478 N/A ALA 190.A N ASP 187.A O no hydrogen 3.016 N/A HIS 194.A N PRO 191.A O no hydrogen 2.929 N/A HIS 194.A NE2 GLU 159.A OE2 no hydrogen 3.157 N/A GLU 196.A N GLU 196.A OE1 no hydrogen 2.642 N/A SER 197.A OG PHE 164.A O no hydrogen 3.400 N/A SER 198.A N HIS 194.A O no hydrogen 3.097 N/A SER 198.A N LEU 195.A O no hydrogen 3.074 N/A SER 198.A OG LEU 195.A O no hydrogen 2.656 N/A LEU 199.A N GLU 196.A O no hydrogen 3.226 N/A LEU 200.A N GLU 196.A O no hydrogen 3.103 N/A SER 201.A N SER 197.A O no hydrogen 3.024 N/A SER 201.A OG SER 197.A O no hydrogen 2.913 N/A HIS 202.A N LEU 199.A O no hydrogen 3.175 N/A LEU 203.A N LEU 200.A O no hydrogen 2.742 N/A VAL 204.A N LEU 200.A O no hydrogen 3.104 N/A ASP 208.A N ASP 205.A O no hydrogen 2.737 N/A LEU 209.A N PRO 206.A O no hydrogen 3.251 N/A GLU 210.A N VAL 128.A O no hydrogen 2.873 N/A ARG 212.A N VAL 130.A O no hydrogen 2.848 N/A ARG 212.A NE GLU 121.A O no hydrogen 2.632 N/A ARG 212.A NH2 GLU 121.A O no hydrogen 3.276 N/A ALA 213.A N GLU 121.A OE1 no hydrogen 2.860 N/A CYS 216.A N ARG 212.A O no hydrogen 2.808 N/A CYS 216.A SG VAL 130.A O no hydrogen 3.725 N/A CYS 216.A SG ARG 212.A O no hydrogen 3.638 N/A THR 217.A N ALA 213.A O no hydrogen 3.081 N/A THR 217.A OG1 ALA 214.A O no hydrogen 2.536 N/A ARG 218.A N ALA 213.A O no hydrogen 3.247 N/A ARG 218.A NH1 GLU 117.A OE1 no hydrogen 2.588 N/A ARG 218.A NH2 GLU 117.A OE1 no hydrogen 2.594 N/A ARG 218.A NH2 GLU 117.A OE2 no hydrogen 3.124 N/A TRP 222.A N THR 113.A O no hydrogen 2.863 N/A HIS 223.A N GLY 134.A O no hydrogen 2.970 N/A THR 224.A OG1 ASP 111.A O no hydrogen 2.908 N/A THR 224.A OG1 THR 113.A OG1 no hydrogen 2.856 N/A THR 226.A OG1 GLU 18.A OE2 no hydrogen 2.521 N/A GLU 235.A N MET 231.A O no hydrogen 3.047 N/A GLN 236.A N LYS 232.A O no hydrogen 3.127 N/A LEU 237.A N GLN 233.A O no hydrogen 2.933 N/A GLN 238.A N GLU 234.A O no hydrogen 3.126 N/A GLN 238.A NE2 GLU 234.A OE2 no hydrogen 3.066 N/A ARG 239.A N GLU 235.A O no hydrogen 3.427 N/A GLN 240.A N GLN 236.A O no hydrogen 3.338 N/A GLY 241.A N GLN 238.A O no hydrogen 2.756 N/A ARG 242.A N LEU 237.A O no hydrogen 2.898 N/A ARG 242.A NE GLN 240.A OE1 no hydrogen 2.986 N/A ARG 242.A NH2 GLN 240.A OE1 no hydrogen 3.151 N/A SER 244.A N GLU 234.A OE2 no hydrogen 2.867 N/A SER 244.A OG GLU 234.A OE1 no hydrogen 2.472 N/A SER 244.A OG GLU 234.A OE2 no hydrogen 3.403 N/A ALA 247.A N ASP 245.A OD1 no hydrogen 2.861 N/A ILE 248.A N ASP 245.A O no hydrogen 3.141 N/A