Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3huj_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N THR 25.A OG1 no hydrogen 3.365 N/A ILE 3.A N ASP 2.A OD1 no hydrogen 2.891 N/A TYR 4.A N SER 23.A O no hydrogen 2.696 N/A GLN 5.A NE2 TYR 88.A O no hydrogen 2.760 N/A GLN 5.A NE2 THR 107.A OG1 no hydrogen 3.360 N/A THR 6.A N GLU 21.A O no hydrogen 3.356 N/A THR 6.A OG1 GLU 21.A OE2 no hydrogen 3.186 N/A ARG 8.A NH1 GLN 5.A O no hydrogen 2.359 N/A ARG 8.A NH1 GLY 106.A O no hydrogen 3.504 N/A ARG 8.A NH2 GLN 5.A O no hydrogen 3.228 N/A LEU 10.A N ARG 108.A O no hydrogen 2.888 N/A ILE 12.A N THR 110.A O no hydrogen 3.303 N/A THR 14.A N THR 112.A O no hydrogen 2.992 N/A THR 14.A OG1 ALA 80.A O no hydrogen 3.065 N/A GLY 15.A N ALA 80.A O no hydrogen 2.550 N/A LYS 17.A NZ GLU 78.A OE2 no hydrogen 3.124 N/A ILE 18.A N LEU 77.A O no hydrogen 2.790 N/A LEU 20.A N LEU 75.A O no hydrogen 2.808 N/A GLU 21.A N THR 6.A O no hydrogen 3.067 N/A CYS 22.A SG TYR 4.A O no hydrogen 4.043 N/A SER 23.A N TYR 4.A O no hydrogen 3.084 N/A SER 23.A OG HIS 72.A ND1 no hydrogen 2.953 N/A GLN 24.A N GLU 71.A O no hydrogen 2.940 N/A GLN 24.A NE2 HIS 28.A O no hydrogen 3.238 N/A THR 25.A N ASP 2.A O no hydrogen 3.219 N/A THR 25.A OG1 ASP 2.A O no hydrogen 3.350 N/A HIS 28.A N GLN 24.A OE1 no hydrogen 2.770 N/A HIS 28.A ND1 SER 92.A OG no hydrogen 3.234 N/A MET 31.A N SER 48.A O no hydrogen 2.941 N/A TYR 32.A N ALA 91.A O no hydrogen 2.800 N/A TYR 32.A OH SER 93.A OG no hydrogen 2.804 N/A TRP 33.A N HIS 46.A O no hydrogen 2.786 N/A TRP 33.A NE1 PHE 73.A O no hydrogen 2.747 N/A TYR 34.A N LEU 89.A O no hydrogen 2.688 N/A GLN 35.A N HIS 43.A O no hydrogen 2.894 N/A GLN 35.A NE2 TYR 88.A OH no hydrogen 3.457 N/A GLN 36.A N GLN 87.A O no hydrogen 2.826 N/A GLN 36.A NE2 MET 40.A O no hydrogen 3.008 N/A MET 40.A N ASP 37.A O no hydrogen 2.742 N/A HIS 43.A N GLN 35.A O no hydrogen 3.015 N/A ILE 45.A N TRP 33.A O no hydrogen 2.963 N/A HIS 46.A N TRP 33.A O no hydrogen 3.523 N/A HIS 46.A NE2 SER 63.A OG no hydrogen 2.663 N/A TYR 47.A N GLU 55.A O no hydrogen 2.744 N/A SER 48.A N MET 31.A O no hydrogen 2.903 N/A SER 48.A OG SER 53.A O no hydrogen 2.626 N/A TYR 49.A N SER 53.A OG no hydrogen 3.010 N/A GLY 50.A N SER 48.A OG no hydrogen 3.336 N/A ASN 52.A N ARG 67.A O no hydrogen 2.554 N/A SER 53.A N GLY 50.A O no hydrogen 3.194 N/A THR 54.A OG1 THR 54.A O no hydrogen 2.610 N/A GLU 55.A N TYR 47.A O no hydrogen 2.792 N/A LYS 56.A NZ.B SER 61.A O no hydrogen 2.880 N/A GLY 57.A N ILE 45.A O no hydrogen 2.678 N/A LEU 59.A N LEU 44.A O no hydrogen 3.157 N/A SER 61.A OG SER 63.A OG no hydrogen 2.794 N/A SER 63.A N SER 61.A OG no hydrogen 3.120 N/A SER 63.A OG HIS 46.A NE2 no hydrogen 2.663 N/A SER 63.A OG SER 61.A OG no hydrogen 2.794 N/A THR 64.A N THR 76.A O no hydrogen 2.772 N/A SER 66.A N PRO 74.A O no hydrogen 3.317 N/A ARG 67.A NE THR 70.A O no hydrogen 3.369 N/A ARG 67.A NH1 ASP 29.A O no hydrogen 2.572 N/A ARG 67.A NH1 SER 48.A OG no hydrogen 2.875 N/A ARG 67.A NH2 HIS 28.A O no hydrogen 3.319 N/A ARG 67.A NH2 ASP 29.A O no hydrogen 2.943 N/A ARG 67.A NH2 THR 70.A O no hydrogen 3.043 N/A HIS 72.A N ARG 69.A O no hydrogen 3.404 N/A PHE 73.A N CYS 22.A O no hydrogen 2.925 N/A LEU 75.A N LEU 20.A O no hydrogen 2.928 N/A THR 76.A N THR 64.A O no hydrogen 2.612 N/A LEU 77.A N ILE 18.A O no hydrogen 2.842 N/A ALA 80.A N LYS 16.A O no hydrogen 2.860 N/A HIS 84.A N ARG 81.A O no hydrogen 2.736 N/A THR 85.A N PRO 82.A O no hydrogen 3.299 N/A THR 85.A OG1 PRO 82.A O no hydrogen 3.003 N/A SER 86.A N LEU 109.A O no hydrogen 3.132 N/A SER 86.A OG GLN 36.A O no hydrogen 3.067 N/A SER 86.A OG ASP 37.A OD1 no hydrogen 3.057 N/A GLN 87.A N GLN 36.A O no hydrogen 2.988 N/A TYR 88.A N THR 107.A O no hydrogen 3.041 N/A TYR 88.A OH HIS 84.A O no hydrogen 2.577 N/A LEU 89.A N TYR 34.A O no hydrogen 2.862 N/A CYS 90.A N GLN 5.A OE1 no hydrogen 2.801 N/A CYS 90.A SG TYR 32.A O no hydrogen 3.612 N/A ALA 91.A N TYR 32.A O no hydrogen 3.003 N/A SER 92.A N TYR 102.A O no hydrogen 3.067 N/A SER 92.A OG HIS 28.A ND1 no hydrogen 3.234 N/A SER 93.A N LYS 30.A O no hydrogen 3.035 N/A SER 93.A OG TYR 32.A OH no hydrogen 2.804 N/A GLY 94.A N GLU 100.A O no hydrogen 3.103 N/A ARG 96.A N LEU 98.A O no hydrogen 3.376 N/A ARG 96.A NH1 ASP 97.A OD2 no hydrogen 2.772 N/A GLU 100.A N GLY 94.A O no hydrogen 2.662 N/A GLN 101.A NE2 TYR 34.A OH no hydrogen 3.030 N/A TYR 102.A N SER 92.A O no hydrogen 2.805 N/A GLY 104.A N CYS 90.A O no hydrogen 2.898 N/A THR 107.A N TYR 88.A O no hydrogen 3.121 N/A THR 107.A OG1 PRO 7.A O no hydrogen 2.954 N/A ARG 108.A N ARG 8.A O no hydrogen 3.040 N/A ARG 108.A NH1 ASP 151.A OD1 no hydrogen 3.012 N/A LEU 109.A N SER 86.A O no hydrogen 2.982 N/A THR 110.A N LEU 10.A O no hydrogen 2.901 N/A THR 110.A OG1 HIS 152.A NE2 no hydrogen 2.693 N/A VAL 111.A N THR 85.A OG1 no hydrogen 2.877 N/A THR 112.A N ILE 12.A O no hydrogen 3.010 N/A THR 112.A OG1 ASP 114.A O no hydrogen 3.137 N/A THR 112.A OG1 ASP 183.A OD2 no hydrogen 2.771 N/A ASP 114.A N THR 112.A OG1 no hydrogen 3.375 N/A LYS 116.A N ASP 114.A OD1 no hydrogen 2.736 N/A ASN 117.A N ASP 114.A O no hydrogen 3.138 N/A ASN 117.A ND2 THR 112.A OG1 no hydrogen 3.237 N/A VAL 118.A N LEU 115.A O no hydrogen 3.082 N/A PHE 119.A N TYR 149.A O no hydrogen 2.900 N/A GLU 122.A N THR 146.A O no hydrogen 2.835 N/A ALA 124.A N LEU 144.A O no hydrogen 3.225 N/A PHE 126.A N VAL 142.A O no hydrogen 2.899 N/A ALA 131.A N SER 129.A OG no hydrogen 3.296 N/A GLU 132.A N SER 129.A O no hydrogen 3.088 N/A ILE 133.A N SER 129.A O no hydrogen 3.404 N/A SER 134.A N GLU 130.A O no hydrogen 3.058 N/A SER 134.A OG ALA 131.A O no hydrogen 2.755 N/A HIS 135.A N ALA 131.A O no hydrogen 3.209 N/A THR 136.A N GLU 132.A O no hydrogen 2.882 N/A THR 136.A OG1 GLU 132.A O no hydrogen 2.574 N/A GLN 137.A N ILE 133.A O no hydrogen 2.884 N/A LYS 138.A N THR 136.A OG1 no hydrogen 3.159 N/A ALA 139.A N VAL 194.A O no hydrogen 3.130 N/A THR 140.A N GLU 132.A OE1 no hydrogen 2.920 N/A THR 140.A OG1 GLU 132.A OE2 no hydrogen 2.438 N/A LEU 141.A N LEU 192.A O no hydrogen 2.697 N/A VAL 142.A N PHE 126.A O no hydrogen 3.330 N/A CYS 143.A N SER 190.A O no hydrogen 2.801 N/A LEU 144.A N ALA 124.A O no hydrogen 3.035 N/A ALA 145.A N LEU 188.A O no hydrogen 2.924 N/A THR 146.A N GLU 122.A O no hydrogen 2.812 N/A GLY 147.A N GLU 177.A OE1 no hydrogen 2.592 N/A PHE 148.A N TYR 186.A O no hydrogen 3.318 N/A TYR 149.A N PHE 119.A O no hydrogen 3.112 N/A HIS 152.A N PRO 150.A O no hydrogen 2.613 N/A HIS 152.A NE2 THR 110.A OG1 no hydrogen 2.693 N/A GLU 154.A N GLN 211.A O no hydrogen 2.803 N/A SER 156.A N GLN 209.A O no hydrogen 2.856 N/A TRP 157.A NE1 SER 190.A OG no hydrogen 2.984 N/A TRP 158.A N ARG 207.A O no hydrogen 2.747 N/A TRP 158.A NE1 SER 156.A OG no hydrogen 3.019 N/A VAL 159.A N LYS 162.A O no hydrogen 2.995 N/A ASN 160.A N HIS 205.A O no hydrogen 2.858 N/A ASN 160.A ND2 ASN 204.A OD1 no hydrogen 3.196 N/A LYS 162.A N VAL 159.A O no hydrogen 3.205 N/A VAL 164.A N TRP 157.A O no hydrogen 3.046 N/A CYS 169.A N ARG 191.A O no hydrogen 3.107 N/A THR 170.A OG1 SER 190.A OG no hydrogen 2.777 N/A ASP 171.A N SER 189.A O no hydrogen 3.224 N/A LEU 175.A N ALA 187.A O no hydrogen 3.008 N/A GLU 177.A N ARG 185.A O no hydrogen 2.658 N/A LEU 181.A N GLN 178.A O no hydrogen 2.944 N/A ASN 182.A ND2 ASP 183.A OD1 no hydrogen 3.559 N/A ARG 185.A NH1 GLY 147.A O no hydrogen 3.345 N/A TYR 186.A N PHE 148.A O no hydrogen 2.677 N/A ALA 187.A N LEU 175.A O no hydrogen 2.857 N/A LEU 188.A N ALA 145.A O no hydrogen 2.905 N/A SER 189.A N ASP 171.A OD2 no hydrogen 3.146 N/A SER 189.A OG ASP 171.A OD2 no hydrogen 2.667 N/A SER 190.A N CYS 143.A O no hydrogen 3.000 N/A SER 190.A OG CYS 169.A O no hydrogen 3.130 N/A SER 190.A OG THR 170.A OG1 no hydrogen 2.777 N/A ARG 191.A N CYS 169.A O no hydrogen 2.948 N/A ARG 191.A NE CYS 169.A O no hydrogen 3.278 N/A ARG 191.A NH1 CYS 169.A O no hydrogen 3.452 N/A ARG 191.A NH1 ASP 171.A OD1 no hydrogen 2.790 N/A LEU 192.A N LEU 141.A O no hydrogen 2.861 N/A ARG 193.A N GLY 167.A O no hydrogen 3.024 N/A ARG 193.A NE GLU 132.A OE2 no hydrogen 3.158 N/A ARG 193.A NH1 GLU 132.A OE2 no hydrogen 2.797 N/A VAL 194.A N ALA 139.A O no hydrogen 3.250 N/A ALA 196.A N GLN 137.A O no hydrogen 3.199 N/A PHE 198.A N SER 195.A OG no hydrogen 3.406 N/A TRP 199.A N SER 195.A O no hydrogen 3.180 N/A GLN 200.A N ALA 196.A O no hydrogen 2.940 N/A ASN 201.A N THR 197.A O no hydrogen 3.112 N/A ARG 203.A N ASN 201.A OD1 no hydrogen 2.831 N/A ASN 204.A ND2 PHE 198.A O no hydrogen 2.575 N/A HIS 205.A N ASN 160.A OD1 no hydrogen 2.994 N/A HIS 205.A NE2 GLU 236.A OE2 no hydrogen 2.686 N/A PHE 206.A N ALA 237.A O no hydrogen 3.027 N/A ARG 207.A N TRP 158.A O no hydrogen 2.853 N/A ARG 207.A NH1 GLN 209.A OE1 no hydrogen 2.884 N/A ARG 207.A NH2 GLN 209.A OE1 no hydrogen 3.223 N/A ARG 207.A NH2 SER 234.A OG no hydrogen 2.841 N/A CYS 208.A N ALA 235.A O no hydrogen 2.815 N/A GLN 209.A N SER 156.A O no hydrogen 2.820 N/A VAL 210.A N VAL 233.A O no hydrogen 2.922 N/A GLN 211.A N GLU 154.A O no hydrogen 2.611 N/A GLN 211.A NE2 PHE 212.A O no hydrogen 3.127 N/A PHE 212.A N GLN 231.A O no hydrogen 2.827 N/A TYR 213.A N HIS 152.A O no hydrogen 3.099 N/A TYR 213.A OH GLU 154.A OE1 no hydrogen 2.676 N/A GLY 214.A N THR 230.A OG1 no hydrogen 3.269 N/A LEU 215.A N PRO 228.A O no hydrogen 2.976 N/A SER 216.A N ASP 219.A OD2 no hydrogen 2.704 N/A SER 216.A OG ASP 219.A OD2 no hydrogen 2.971 N/A ASP 219.A N SER 216.A O no hydrogen 3.336 N/A TRP 221.A NE1 ARG 225.A O no hydrogen 3.248 N/A THR 222.A OG1 GLU 220.A OE1 no hydrogen 3.501 N/A ARG 225.A NH1 VAL 118.A O no hydrogen 3.388 N/A ARG 225.A NH2 LYS 116.A O no hydrogen 3.320 N/A ARG 225.A NH2 VAL 118.A O no hydrogen 2.660 N/A LYS 227.A NZ SER 216.A O no hydrogen 2.802 N/A LYS 227.A NZ ASP 219.A O no hydrogen 2.763 N/A VAL 229.A N LYS 227.A O no hydrogen 2.687 N/A THR 230.A N LEU 215.A O no hydrogen 3.342 N/A GLN 231.A N PHE 212.A O no hydrogen 3.084 N/A VAL 233.A N VAL 210.A O no hydrogen 2.978 N/A ALA 235.A N CYS 208.A O no hydrogen 3.090 N/A ALA 237.A N PHE 206.A O no hydrogen 2.942 N/A GLY 239.A N ASN 204.A O no hydrogen 3.117 N/A