Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fux_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLU 29.A OE2 no hydrogen 3.209 N/A SER 2.A N SER 5.A OG no hydrogen 3.002 N/A SER 5.A N SER 2.A OG no hydrogen 3.054 N/A SER 5.A OG SER 2.A O no hydrogen 3.305 N/A SER 5.A OG SER 2.A OG no hydrogen 3.236 N/A VAL 6.A N SER 2.A O no hydrogen 2.900 N/A ARG 7.A N PRO 3.A O no hydrogen 3.157 N/A ALA 8.A N GLN 4.A O no hydrogen 2.925 N/A LEU 9.A N SER 5.A O no hydrogen 2.878 N/A LEU 10.A N VAL 6.A O no hydrogen 3.001 N/A GLU 11.A N ARG 7.A O no hydrogen 3.061 N/A ARG 12.A N ALA 8.A O no hydrogen 2.904 N/A ARG 12.A NH1 GLU 82.A OE2 no hydrogen 2.822 N/A ARG 12.A NH2 GLU 82.A OE1 no hydrogen 2.856 N/A ARG 12.A NH2 GLU 82.A OE2 no hydrogen 3.520 N/A HIS 13.A N LEU 9.A O no hydrogen 3.177 N/A HIS 13.A N LEU 10.A O no hydrogen 3.158 N/A HIS 13.A NE2 GLU 82.A OE1 no hydrogen 2.976 N/A GLY 14.A N GLU 11.A O no hydrogen 3.069 N/A LEU 15.A N LEU 10.A O no hydrogen 2.841 N/A ASP 18.A N GLN 23.A OE1 no hydrogen 2.840 N/A ARG 20.A N ASP 18.A OD1 no hydrogen 2.877 N/A PHE 21.A N ASP 18.A O no hydrogen 3.035 N/A GLY 22.A N LYS 19.A O no hydrogen 2.995 N/A GLN 23.A N ASP 18.A O no hydrogen 3.311 N/A GLN 23.A NE2 ASP 73.A OD2 no hydrogen 2.878 N/A ASN 24.A ND2 PRO 182.A O no hydrogen 2.798 N/A PHE 25.A N PHE 181.A O no hydrogen 2.874 N/A VAL 27.A N ALA 179.A O no hydrogen 2.951 N/A SER 28.A OG HIS 31.A ND1 no hydrogen 2.836 N/A HIS 31.A N SER 28.A OG no hydrogen 3.175 N/A HIS 31.A ND1 SER 28.A OG no hydrogen 2.836 N/A LEU 32.A N SER 28.A O no hydrogen 2.981 N/A ARG 33.A N GLU 29.A O no hydrogen 2.957 N/A ARG 34.A N ALA 30.A O no hydrogen 3.044 N/A ILE 35.A N HIS 31.A O no hydrogen 2.963 N/A VAL 36.A N LEU 32.A O no hydrogen 3.086 N/A GLU 37.A N ARG 33.A O no hydrogen 2.972 N/A ALA 38.A N ARG 34.A O no hydrogen 3.057 N/A ALA 39.A N VAL 36.A O no hydrogen 3.042 N/A ARG 40.A N GLU 37.A O no hydrogen 3.258 N/A ARG 40.A NE GLU 37.A OE1 no hydrogen 3.195 N/A ARG 40.A NE GLU 37.A OE2 no hydrogen 3.246 N/A ARG 40.A NH2 GLU 37.A OE2 no hydrogen 3.313 N/A THR 43.A N PRO 41.A O no hydrogen 2.981 N/A VAL 46.A N GLU 66.A O no hydrogen 2.776 N/A PHE 47.A N LEU 109.A O no hydrogen 2.740 N/A GLU 48.A N THR 68.A O no hydrogen 2.803 N/A GLY 50.A N ILE 70.A O no hydrogen 2.848 N/A GLY 52.A N GLU 71.A OE1 no hydrogen 3.184 N/A GLY 54.A N PRO 51.A O no hydrogen 2.859 N/A THR 57.A OG1 GLU 48.A OE1 no hydrogen 2.562 N/A THR 57.A OG1 GLU 48.A OE2 no hydrogen 3.524 N/A ARG 58.A N GLY 54.A O no hydrogen 2.816 N/A ALA 59.A N ALA 55.A O no hydrogen 3.277 N/A LEU 60.A N LEU 56.A O no hydrogen 2.817 N/A LEU 61.A N THR 57.A O no hydrogen 2.995 N/A GLU 62.A N ARG 58.A O no hydrogen 2.891 N/A ALA 63.A N ALA 59.A O no hydrogen 3.069 N/A GLY 64.A N LEU 61.A O no hydrogen 3.008 N/A ALA 65.A N LEU 60.A O no hydrogen 3.082 N/A THR 68.A N VAL 46.A O no hydrogen 2.840 N/A ALA 69.A N ARG 90.A O no hydrogen 2.775 N/A ILE 70.A N GLU 48.A O no hydrogen 2.833 N/A GLU 71.A N VAL 92.A O no hydrogen 2.869 N/A ASP 73.A N GLU 71.A OE2 no hydrogen 2.911 N/A ARG 75.A N ASP 73.A OD1 no hydrogen 2.974 N/A ARG 75.A NE ASP 73.A OD1 no hydrogen 2.951 N/A ARG 75.A NE ASP 73.A OD2 no hydrogen 3.249 N/A ARG 75.A NH2 ASP 18.A OD2 no hydrogen 2.693 N/A ARG 75.A NH2 ASP 73.A OD2 no hydrogen 2.973 N/A LEU 76.A N ASP 73.A O no hydrogen 2.987 N/A ARG 77.A N LEU 74.A O no hydrogen 3.039 N/A LEU 80.A N LEU 76.A O no hydrogen 2.921 N/A GLU 81.A N ARG 77.A O no hydrogen 2.881 N/A GLU 82.A N PRO 78.A O no hydrogen 3.027 N/A THR 83.A N VAL 79.A O no hydrogen 2.842 N/A THR 83.A OG1 LEU 53.A O no hydrogen 2.851 N/A THR 83.A OG1 VAL 79.A O no hydrogen 3.099 N/A LEU 84.A N LEU 80.A O no hydrogen 2.941 N/A SER 85.A N GLU 82.A O no hydrogen 3.338 N/A LEU 87.A N LEU 84.A O no hydrogen 2.932 N/A ARG 90.A N VAL 67.A O no hydrogen 3.045 N/A VAL 92.A N ALA 69.A O no hydrogen 2.835 N/A GLN 94.A N GLU 71.A O no hydrogen 3.000 N/A LEU 97.A N ASP 95.A OD1 no hydrogen 2.917 N/A LEU 98.A N ASP 95.A O no hydrogen 3.023 N/A TYR 99.A N ALA 96.A O no hydrogen 3.230 N/A TRP 101.A N TYR 99.A O no hydrogen 2.870 N/A TRP 101.A NE1 ALA 96.A O no hydrogen 2.739 N/A GLU 103.A N PRO 100.A O no hydrogen 3.192 N/A VAL 104.A N TRP 101.A O no hydrogen 3.226 N/A GLN 106.A NE2 GLY 130.A O no hydrogen 2.952 N/A GLY 107.A N ARG 131.A O no hydrogen 2.761 N/A SER 108.A N PRO 105.A O no hydrogen 3.086 N/A SER 108.A OG PRO 105.A O no hydrogen 2.657 N/A LEU 109.A N PRO 45.A O no hydrogen 2.800 N/A LEU 110.A N ARG 134.A O no hydrogen 3.088 N/A VAL 111.A N PHE 47.A O no hydrogen 2.967 N/A ALA 112.A N VAL 136.A O no hydrogen 2.987 N/A ASN 113.A ND2 ASN 24.A O no hydrogen 3.152 N/A ILE 118.A N PRO 115.A O no hydrogen 3.274 N/A LEU 122.A N ILE 118.A O no hydrogen 2.865 N/A VAL 123.A N ALA 119.A O no hydrogen 2.879 N/A THR 124.A N THR 120.A O no hydrogen 2.927 N/A THR 124.A OG1 THR 120.A O no hydrogen 2.833 N/A ARG 125.A N PRO 121.A O no hydrogen 2.999 N/A ARG 125.A NE GLU 102.A OE2 no hydrogen 2.756 N/A ARG 125.A NH2 GLU 102.A OE1 no hydrogen 2.564 N/A ARG 125.A NH2 GLU 102.A OE2 no hydrogen 3.418 N/A LEU 126.A N LEU 122.A O no hydrogen 2.926 N/A LEU 127.A N VAL 123.A O no hydrogen 2.879 N/A LYS 128.A N THR 124.A O no hydrogen 3.081 N/A THR 129.A N ARG 125.A O no hydrogen 3.157 N/A THR 129.A N LEU 126.A O no hydrogen 3.179 N/A THR 129.A OG1 LEU 126.A O no hydrogen 2.700 N/A GLY 130.A N LEU 127.A O no hydrogen 3.122 N/A ARG 131.A N THR 129.A OG1 no hydrogen 3.036 N/A ARG 131.A NH1 VAL 104.A O no hydrogen 2.667 N/A ALA 133.A N SER 108.A O no hydrogen 2.822 N/A ARG 134.A NH2 ALA 39.A O no hydrogen 2.990 N/A ARG 134.A NH2 PRO 41.A O no hydrogen 2.724 N/A LEU 135.A N LEU 193.A O no hydrogen 2.918 N/A VAL 136.A N LEU 110.A O no hydrogen 2.771 N/A PHE 137.A N VAL 191.A O no hydrogen 2.970 N/A LEU 138.A N ALA 112.A O no hydrogen 2.978 N/A VAL 139.A N SER 189.A O no hydrogen 3.116 N/A LYS 141.A N TRP 187.A O no hydrogen 2.867 N/A ALA 144.A N GLN 140.A O no hydrogen 2.998 N/A GLU 145.A N LYS 141.A O no hydrogen 2.872 N/A ARG 146.A N GLU 142.A O no hydrogen 2.956 N/A MET 147.A N VAL 143.A O no hydrogen 2.905 N/A THR 148.A N ALA 144.A O no hydrogen 3.029 N/A THR 148.A OG1 ALA 144.A O no hydrogen 2.714 N/A ALA 149.A N ARG 146.A O no hydrogen 3.493 N/A LYS 152.A N GLU 249.A O no hydrogen 2.738 N/A THR 153.A OG1 ARG 150.A O no hydrogen 2.735 N/A TYR 156.A N THR 153.A O no hydrogen 2.967 N/A TYR 156.A OH LEU 251.A O no hydrogen 2.632 N/A GLY 157.A N THR 160.A OG1 no hydrogen 3.027 N/A THR 160.A OG1 ARG 146.A O no hydrogen 2.714 N/A THR 160.A OG1 GLY 157.A O no hydrogen 3.438 N/A LEU 161.A N GLY 157.A O no hydrogen 3.151 N/A ARG 162.A N VAL 158.A O no hydrogen 2.774 N/A ARG 162.A NH1 HIS 166.A NE2 no hydrogen 3.046 N/A ARG 162.A NH1 ASP 200.A OD1 no hydrogen 2.824 N/A ARG 162.A NH2 ASP 200.A OD1 no hydrogen 3.462 N/A VAL 163.A N LEU 159.A O no hydrogen 2.932 N/A ALA 164.A N THR 160.A O no hydrogen 2.927 N/A HIS 165.A N LEU 161.A O no hydrogen 2.851 N/A HIS 165.A NE2 LEU 199.A O no hydrogen 2.789 N/A HIS 166.A N VAL 163.A O no hydrogen 3.035 N/A HIS 166.A ND1 ALA 198.A O no hydrogen 2.942 N/A ALA 167.A N VAL 163.A O no hydrogen 2.867 N/A VAL 168.A N THR 194.A O no hydrogen 2.902 N/A GLU 170.A N ARG 192.A O no hydrogen 2.912 N/A ARG 171.A NE ASP 174.A OD1 no hydrogen 2.929 N/A ARG 171.A NH2 ASP 174.A OD1 no hydrogen 3.499 N/A ARG 171.A NH2 ASP 174.A OD2 no hydrogen 2.928 N/A LEU 172.A N LEU 190.A O no hydrogen 2.798 N/A LEU 175.A N SER 188.A O no hydrogen 2.793 N/A ALA 179.A N PRO 176.A O no hydrogen 2.900 N/A PHE 180.A N PRO 177.A O no hydrogen 3.029 N/A PHE 181.A N PHE 25.A O no hydrogen 2.891 N/A SER 188.A N LEU 175.A O no hydrogen 2.966 N/A SER 189.A N VAL 139.A O no hydrogen 2.851 N/A SER 189.A OG ASP 174.A OD1 no hydrogen 2.718 N/A LEU 190.A N PHE 173.A O no hydrogen 2.838 N/A VAL 191.A N PHE 137.A O no hydrogen 2.894 N/A ARG 192.A N GLU 170.A O no hydrogen 2.848 N/A ARG 192.A NE GLU 170.A OE1 no hydrogen 2.802 N/A ARG 192.A NH1 ALA 38.A O no hydrogen 2.958 N/A ARG 192.A NH2 GLU 170.A OE1 no hydrogen 3.445 N/A ARG 192.A NH2 GLU 170.A OE2 no hydrogen 2.995 N/A LEU 193.A N LEU 135.A O no hydrogen 2.796 N/A THR 194.A N VAL 168.A O no hydrogen 2.838 N/A THR 196.A N HIS 166.A O no hydrogen 2.909 N/A THR 196.A OG1 HIS 166.A O no hydrogen 3.336 N/A ALA 198.A N THR 196.A OG1 no hydrogen 3.367 N/A LEU 204.A N ASP 201.A OD1 no hydrogen 3.267 N/A PHE 205.A N ASP 201.A O no hydrogen 3.068 N/A ARG 206.A N PRO 202.A O no hydrogen 2.879 N/A LEU 207.A N GLY 203.A O no hydrogen 3.240 N/A VAL 208.A N LEU 204.A O no hydrogen 2.877 N/A GLU 209.A N.A PHE 205.A O no hydrogen 2.821 N/A GLU 209.A N.B PHE 205.A O no hydrogen 2.803 N/A ALA 210.A N ARG 206.A O no hydrogen 2.984 N/A ALA 211.A N LEU 207.A O no hydrogen 2.887 N/A PHE 212.A N VAL 208.A O no hydrogen 3.180 N/A GLY 213.A N ALA 210.A O no hydrogen 3.248 N/A LYS 217.A N LYS 214.A O no hydrogen 3.396 N/A LEU 219.A N VAL 246.A O no hydrogen 2.888 N/A ASN 221.A N THR 218.A OG1 no hydrogen 3.272 N/A ALA 222.A N THR 218.A O no hydrogen 2.824 N/A LEU 223.A N LEU 219.A O no hydrogen 2.940 N/A ALA 224.A N LEU 220.A O no hydrogen 2.928 N/A ALA 225.A N ASN 221.A O no hydrogen 3.003 N/A ALA 226.A N ALA 222.A O no hydrogen 3.252 N/A ALA 226.A N LEU 223.A O no hydrogen 3.079 N/A GLY 227.A N ALA 224.A O no hydrogen 3.093 N/A TYR 228.A N LEU 223.A O no hydrogen 3.011 N/A VAL 233.A N PRO 229.A O no hydrogen 3.034 N/A GLU 234.A N LYS 230.A O no hydrogen 2.779 N/A GLU 235.A N ALA 231.A O no hydrogen 3.037 N/A ALA 236.A N ARG 232.A O no hydrogen 3.172 N/A LEU 237.A N VAL 233.A O no hydrogen 2.994 N/A ARG 238.A N GLU 234.A O no hydrogen 3.052 N/A ARG 238.A NE GLU 235.A OE1 no hydrogen 3.455 N/A ARG 238.A NE GLU 235.A OE2 no hydrogen 3.027 N/A ARG 238.A NH2 GLU 235.A OE1 no hydrogen 3.167 N/A ALA 239.A N GLU 235.A O no hydrogen 2.925 N/A LEU 240.A N ALA 236.A O no hydrogen 3.255 N/A LEU 240.A N LEU 237.A O no hydrogen 3.134 N/A GLY 241.A N ARG 238.A O no hydrogen 3.006 N/A LEU 242.A N LEU 237.A O no hydrogen 3.063 N/A VAL 246.A N PRO 243.A O no hydrogen 2.997 N/A ARG 247.A N GLU 250.A OE2 no hydrogen 2.895 N/A ARG 247.A NE GLU 249.A OE2 no hydrogen 2.736 N/A ARG 247.A NH1 ARG 215.A O no hydrogen 3.175 N/A ARG 247.A NH2 ARG 215.A O no hydrogen 2.719 N/A ARG 247.A NH2 GLU 249.A OE2 no hydrogen 3.310 N/A GLU 249.A N GLU 249.A OE1 no hydrogen 2.796 N/A GLU 250.A N ARG 247.A O no hydrogen 3.008 N/A LEU 251.A N ALA 248.A O no hydrogen 3.162 N/A ALA 255.A N ASP 252.A OD1 no hydrogen 2.907 N/A PHE 256.A N ASP 252.A O no hydrogen 3.039 N/A ARG 257.A N LEU 253.A O no hydrogen 2.870 N/A ARG 258.A N GLU 254.A O no hydrogen 3.027 N/A ARG 258.A NE GLU 254.A OE1 no hydrogen 2.872 N/A LEU 259.A N ALA 255.A O no hydrogen 2.833 N/A ARG 260.A N PHE 256.A O no hydrogen 2.988 N/A ARG 260.A NE GLU 264.A OE1 no hydrogen 3.298 N/A ARG 260.A NE GLU 264.A OE2 no hydrogen 2.848 N/A ARG 260.A NH1 ASP 201.A OD1 no hydrogen 3.269 N/A ARG 260.A NH1 ASP 201.A OD2 no hydrogen 2.808 N/A ARG 260.A NH2 ASP 201.A OD1 no hydrogen 2.923 N/A GLU 261.A N ARG 257.A O no hydrogen 3.191 N/A GLY 262.A N ARG 258.A O no hydrogen 2.999 N/A LEU 263.A N LEU 259.A O no hydrogen 3.054 N/A GLU 264.A N ARG 260.A O no hydrogen 3.164 N/A GLU 264.A N GLU 261.A O no hydrogen 3.276 N/A