Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ac8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ARG 209.A O no hydrogen 2.965 N/A ILE 3.A N VAL 211.A O no hydrogen 2.816 N/A ALA 5.A N VAL 213.A O no hydrogen 2.890 N/A LEU 6.A N HIS 40.A O no hydrogen 3.010 N/A LEU 8.A N VAL 42.A O no hydrogen 2.887 N/A ILE 9.A N.A THR 12.A O no hydrogen 2.964 N/A ILE 9.A N.B THR 12.A O no hydrogen 2.939 N/A GLY 10.A N THR 45.A OG1 no hydrogen 2.847 N/A GLY 11.A N GLN 54.A OE1 no hydrogen 2.945 N/A THR 12.A N ILE 9.A O.A no hydrogen 2.831 N/A THR 12.A N ILE 9.A O.B no hydrogen 2.838 N/A THR 12.A OG1 ASN 22.A OD1 no hydrogen 2.680 N/A VAL 13.A N GLY 21.A O no hydrogen 2.888 N/A VAL 14.A N ASP 7.A O no hydrogen 3.066 N/A ARG 15.A N ARG 18.A O no hydrogen 3.082 N/A ARG 15.A NH1 TYR 20.A OH no hydrogen 3.302 N/A ARG 18.A N ARG 15.A O no hydrogen 3.106 N/A TYR 20.A N VAL 13.A O no hydrogen 2.783 N/A GLY 21.A N ASP 19.A OD1 no hydrogen 2.565 N/A ARG 27.A NE ASP 23.A OD1 no hydrogen 3.391 N/A ARG 27.A NH2 TYR 20.A O no hydrogen 2.973 N/A LEU 28.A N PRO 24.A O no hydrogen 2.992 N/A GLN 29.A N LEU 25.A O no hydrogen 2.841 N/A GLN 29.A NE2 GLY 64.A O no hydrogen 2.961 N/A ASP 30.A N PRO 26.A O no hydrogen 3.006 N/A TYR 31.A N ARG 27.A O no hydrogen 3.029 N/A ALA 32.A N LEU 28.A O no hydrogen 2.971 N/A ALA 33.A N GLN 29.A O no hydrogen 2.891 N/A GLN 34.A N ASP 30.A O no hydrogen 3.224 N/A GLN 34.A N TYR 31.A O no hydrogen 3.237 N/A GLN 34.A NE2 ASP 30.A O no hydrogen 3.254 N/A GLY 35.A N ALA 32.A O no hydrogen 3.040 N/A ALA 36.A N TYR 31.A O no hydrogen 3.418 N/A LEU 39.A N PRO 68.A O no hydrogen 3.063 N/A HIS 40.A N PRO 4.A O no hydrogen 2.937 N/A LEU 41.A N GLN 70.A O no hydrogen 2.846 N/A VAL 42.A N LEU 6.A O no hydrogen 3.002 N/A ASP 43.A N GLY 72.A O no hydrogen 2.858 N/A LEU 44.A N LEU 8.A O no hydrogen 2.904 N/A GLY 46.A N ASP 43.A OD1 no hydrogen 2.921 N/A ALA 47.A N ASP 43.A O no hydrogen 2.967 N/A LYS 48.A N LEU 44.A O no hydrogen 3.175 N/A LYS 48.A N THR 45.A O no hydrogen 3.261 N/A ASP 49.A N THR 45.A O no hydrogen 3.035 N/A ALA 51.A N ASP 49.A OD1 no hydrogen 3.149 N/A LYS 52.A N ASP 49.A O no hydrogen 2.719 N/A LYS 52.A NZ ASP 49.A OD2 no hydrogen 3.374 N/A ARG 53.A N PRO 50.A O no hydrogen 3.226 N/A ARG 53.A NH1 GLY 73.A O no hydrogen 2.862 N/A ARG 53.A NH1 GLY 74.A O no hydrogen 3.287 N/A ARG 53.A NH2 GLY 74.A O no hydrogen 2.755 N/A GLN 54.A N ASP 43.A OD2 no hydrogen 2.961 N/A GLN 54.A NE2 LEU 8.A O no hydrogen 3.220 N/A GLN 54.A NE2 ASP 43.A OD1 no hydrogen 2.492 N/A ILE 55.A N ARG 53.A O no hydrogen 2.798 N/A ILE 58.A N GLN 54.A O no hydrogen 2.969 N/A LYS 59.A N ILE 55.A O no hydrogen 2.842 N/A THR 60.A N PRO 56.A O no hydrogen 3.183 N/A THR 60.A OG1.A PRO 56.A O no hydrogen 3.531 N/A THR 60.A OG1.A LEU 57.A O no hydrogen 2.515 N/A THR 60.A OG1.B PRO 56.A O no hydrogen 3.106 N/A LEU 61.A N LEU 57.A O no hydrogen 2.889 N/A VAL 62.A N ILE 58.A O no hydrogen 2.917 N/A ALA 63.A N LYS 59.A O no hydrogen 2.966 N/A GLY 64.A N LEU 61.A O no hydrogen 3.080 N/A GLN 70.A N LEU 39.A O no hydrogen 2.859 N/A GLN 70.A NE2 HIS 40.A ND1 no hydrogen 2.961 N/A GLN 70.A NE2 GLN 189.A OE1 no hydrogen 2.895 N/A VAL 71.A N ARG 91.A O no hydrogen 2.985 N/A GLY 72.A N LEU 41.A O no hydrogen 2.979 N/A ARG 76.A N ASP 80.A OD2 no hydrogen 2.883 N/A THR 77.A N ASP 80.A OD2 no hydrogen 2.902 N/A ASP 80.A N THR 77.A OG1 no hydrogen 3.129 N/A VAL 81.A N THR 77.A O no hydrogen 3.234 N/A ALA 82.A N GLU 78.A O no hydrogen 2.996 N/A ALA 83.A N GLU 79.A O no hydrogen 2.930 N/A LEU 84.A N ASP 80.A O no hydrogen 3.108 N/A LEU 85.A N VAL 81.A O no hydrogen 3.000 N/A LYS 86.A N ALA 82.A O no hydrogen 2.863 N/A ALA 87.A N ALA 83.A O no hydrogen 3.063 N/A ALA 87.A N LEU 84.A O no hydrogen 3.059 N/A GLY 88.A N LEU 85.A O no hydrogen 2.975 N/A VAL 89.A N LEU 84.A O no hydrogen 3.246 N/A ALA 90.A N VAL 69.A O no hydrogen 3.073 N/A ARG 91.A N VAL 69.A O no hydrogen 3.476 N/A ARG 91.A NE GLN 70.A OE1 no hydrogen 3.304 N/A ARG 91.A NH2 GLN 70.A OE1 no hydrogen 2.864 N/A VAL 92.A N ALA 116.A O no hydrogen 2.848 N/A VAL 93.A N VAL 71.A O no hydrogen 2.838 N/A ILE 94.A N VAL 118.A O no hydrogen 2.787 N/A THR 97.A OG1 VAL 75.A O no hydrogen 3.075 N/A ALA 98.A N ALA 95.A O no hydrogen 2.896 N/A VAL 99.A N SER 96.A O no hydrogen 3.025 N/A LYS 100.A N SER 96.A O no hydrogen 2.927 N/A SER 101.A N THR 97.A O no hydrogen 2.937 N/A VAL 105.A N SER 101.A O no hydrogen 3.017 N/A LYS 106.A N PRO 102.A O no hydrogen 2.789 N/A GLY 107.A N ASP 103.A O no hydrogen 3.330 N/A TRP 108.A N VAL 104.A O no hydrogen 3.260 N/A PHE 109.A N VAL 105.A O no hydrogen 3.040 N/A GLU 110.A N LYS 106.A O no hydrogen 3.176 N/A ARG 111.A N GLY 107.A O no hydrogen 2.966 N/A ARG 111.A NH1 GLU 78.A OE2 no hydrogen 2.615 N/A PHE 112.A N TRP 108.A O no hydrogen 2.839 N/A GLY 113.A N PHE 109.A O no hydrogen 2.884 N/A ALA 116.A N GLY 113.A O no hydrogen 3.117 N/A LEU 117.A N ALA 114.A O no hydrogen 3.520 N/A VAL 118.A N VAL 92.A O no hydrogen 2.901 N/A LEU 119.A N HIS 160.A O no hydrogen 3.044 N/A ALA 120.A N ILE 94.A O no hydrogen 2.842 N/A LEU 121.A N LEU 162.A O no hydrogen 2.799 N/A VAL 123.A N THR 164.A O no hydrogen 2.813 N/A ARG 124.A N GLN 132.A O no hydrogen 2.834 N/A ARG 124.A NH1 GLN 139.A O no hydrogen 2.865 N/A ARG 124.A NH1 ASN 141.A OD1 no hydrogen 2.864 N/A ARG 124.A NH2 GLY 137.A O no hydrogen 2.865 N/A ARG 124.A NH2 GLN 139.A O no hydrogen 2.783 N/A ILE 125.A N SER 167.A OG no hydrogen 3.122 N/A ASP 126.A N THR 130.A O no hydrogen 2.996 N/A GLU 127.A N GLU 127.A OE1 no hydrogen 2.705 N/A GLY 129.A N ASP 126.A O no hydrogen 3.023 N/A GLY 129.A N ASP 126.A OD1 no hydrogen 2.920 N/A THR 130.A N ASP 126.A OD1 no hydrogen 2.908 N/A LYS 131.A NZ GLU 147.A OE2 no hydrogen 2.928 N/A LYS 131.A NZ GLU 178.A OE1 no hydrogen 2.823 N/A GLN 132.A N ARG 124.A O no hydrogen 2.831 N/A GLN 132.A NE2 ASP 126.A OD2 no hydrogen 2.733 N/A VAL 133.A N VAL 144.A O no hydrogen 2.907 N/A ALA 134.A N ASP 122.A O no hydrogen 2.953 N/A GLN 139.A N SER 136.A O no hydrogen 3.481 N/A GLN 139.A NE2 SER 136.A OG no hydrogen 2.892 N/A SER 142.A N VAL 133.A O no hydrogen 3.027 N/A SER 142.A OG.B VAL 133.A O no hydrogen 2.879 N/A SER 145.A N GLN 148.A OE1 no hydrogen 2.991 N/A LEU 146.A N LYS 131.A O no hydrogen 2.907 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.882 N/A GLN 148.A N SER 145.A OG no hydrogen 3.040 N/A LEU 149.A N SER 145.A O no hydrogen 3.020 N/A VAL 150.A N LEU 146.A O no hydrogen 2.866 N/A GLU 151.A N GLU 147.A O no hydrogen 2.963 N/A THR 152.A N GLN 148.A O no hydrogen 3.122 N/A THR 152.A N LEU 149.A O no hydrogen 3.081 N/A THR 152.A OG1 GLN 148.A O no hydrogen 2.980 N/A TYR 153.A N VAL 150.A O no hydrogen 3.027 N/A TYR 153.A OH ALA 98.A O no hydrogen 2.619 N/A LEU 154.A N VAL 150.A O no hydrogen 3.067 N/A VAL 156.A N TYR 153.A O no hydrogen 3.054 N/A GLY 157.A N LEU 154.A O no hydrogen 2.969 N/A LEU 158.A N TYR 153.A O no hydrogen 3.385 N/A LYS 159.A NZ GLN 185.A O no hydrogen 2.921 N/A HIS 160.A NE2 GLN 115.A OE1 no hydrogen 3.105 N/A VAL 161.A N ALA 187.A O no hydrogen 3.287 N/A LEU 162.A N LEU 119.A O no hydrogen 2.734 N/A CYS 163.A N GLN 189.A O no hydrogen 2.824 N/A THR 164.A N LEU 121.A O no hydrogen 3.017 N/A ILE 166.A N VAL 123.A O no hydrogen 2.882 N/A SER 167.A N ASP 165.A OD1 no hydrogen 2.880 N/A SER 167.A OG ASP 165.A OD1 no hydrogen 2.837 N/A ARG 168.A NH1 GLY 170.A O no hydrogen 3.099 N/A LEU 172.A N GLY 193.A O no hydrogen 3.047 N/A SER 174.A OG GLU 178.A OE2 no hydrogen 3.397 N/A TYR 176.A OH CYS 163.A O no hydrogen 2.718 N/A GLU 177.A N VAL 173.A O no hydrogen 3.049 N/A GLU 178.A N SER 174.A O no hydrogen 3.002 N/A VAL 179.A N LEU 175.A O no hydrogen 3.161 N/A CYS 180.A N TYR 176.A O no hydrogen 2.995 N/A CYS 180.A SG TYR 176.A O no hydrogen 3.148 N/A ALA 181.A N GLU 177.A O no hydrogen 3.211 N/A ARG 182.A N GLU 178.A O no hydrogen 3.168 N/A ARG 182.A NE GLU 151.A OE2 no hydrogen 3.506 N/A ARG 182.A NE TYR 183.A OH no hydrogen 2.981 N/A ARG 182.A NH2 GLU 151.A OE2 no hydrogen 3.049 N/A TYR 183.A N VAL 179.A O no hydrogen 3.098 N/A TYR 183.A OH GLU 151.A OE2 no hydrogen 2.545 N/A GLN 185.A N GLN 185.A OE1 no hydrogen 2.652 N/A ILE 186.A N TYR 183.A O no hydrogen 3.018 N/A ALA 187.A N LYS 159.A O no hydrogen 2.817 N/A GLN 189.A N VAL 161.A O no hydrogen 2.736 N/A GLN 189.A NE2 GLN 70.A OE1 no hydrogen 3.258 N/A SER 190.A N GLY 210.A O no hydrogen 2.850 N/A SER 190.A OG.A GLY 210.A O no hydrogen 3.521 N/A SER 190.A OG.B TYR 176.A OH no hydrogen 2.769 N/A SER 191.A N CYS 163.A O no hydrogen 3.114 N/A SER 191.A OG THR 164.A OG1 no hydrogen 3.416 N/A GLY 195.A N ASP 199.A OD2 no hydrogen 2.670 N/A ASP 196.A N ASP 199.A OD2 no hydrogen 3.019 N/A ASP 198.A N ASP 196.A OD1 no hydrogen 2.856 N/A ASP 199.A N ASP 196.A O no hydrogen 3.041 N/A ASP 199.A N ASP 196.A OD1 no hydrogen 3.316 N/A ILE 200.A N ILE 197.A O no hydrogen 3.147 N/A ALA 201.A N ILE 197.A O no hydrogen 3.288 N/A ALA 202.A N ASP 198.A O no hydrogen 3.059 N/A LEU 203.A N ILE 200.A O no hydrogen 3.102 N/A ARG 204.A N ALA 201.A O no hydrogen 3.121 N/A ARG 204.A NH1 CYS 230.A O no hydrogen 2.897 N/A THR 206.A N LEU 203.A O no hydrogen 3.169 N/A THR 206.A OG1 LEU 203.A O no hydrogen 2.640 N/A VAL 208.A N THR 206.A OG1 no hydrogen 3.284 N/A ARG 209.A N PHE 188.A O no hydrogen 2.812 N/A GLY 210.A N PHE 188.A O no hydrogen 3.056 N/A VAL 211.A N MET 1.A O no hydrogen 2.893 N/A ILE 212.A N SER 190.A O no hydrogen 2.848 N/A VAL 213.A N ILE 3.A O no hydrogen 3.062 N/A ARG 215.A NE GLU 219.A OE1 no hydrogen 3.365 N/A ARG 215.A NE GLU 219.A OE2 no hydrogen 2.728 N/A ARG 215.A NH2 GLU 219.A OE2 no hydrogen 2.386 N/A LEU 217.A N GLY 214.A O no hydrogen 3.166 N/A LEU 218.A N GLY 214.A O no hydrogen 3.460 N/A GLU 219.A N ARG 215.A O no hydrogen 2.871 N/A GLY 220.A N LEU 217.A O no hydrogen 3.220 N/A LYS 221.A N ALA 216.A O no hydrogen 3.051 N/A LYS 221.A NZ GLY 195.A O no hydrogen 3.291 N/A THR 223.A N GLU 226.A OE1 no hydrogen 2.993 N/A LYS 225.A N GLN 34.A OE1 no hydrogen 3.002 N/A GLU 226.A N THR 223.A OG1 no hydrogen 3.105 N/A ALA 227.A N THR 223.A O no hydrogen 2.918 N/A ILE 228.A N VAL 224.A O no hydrogen 2.884 N/A GLN 229.A N LYS 225.A O no hydrogen 2.980 N/A CYS 230.A N GLU 226.A O no hydrogen 2.994 N/A CYS 230.A SG ILE 197.A O no hydrogen 3.774 N/A TRP 231.A N ALA 227.A O no hydrogen 2.868 N/A GLN 232.A N ILE 228.A O no hydrogen 2.913 N/A ASN 233.A N CYS 230.A O no hydrogen 2.857 N/A