Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ac7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ARG 223.A O no hydrogen 2.927 N/A ILE 3.A N VAL 225.A O no hydrogen 2.728 N/A ALA 5.A N VAL 227.A O no hydrogen 2.965 N/A LEU 6.A N HIS 50.A O no hydrogen 2.930 N/A LEU 8.A N VAL 52.A O no hydrogen 2.849 N/A ILE 9.A N THR 12.A O no hydrogen 3.019 N/A GLY 10.A N.A THR 55.A OG1 no hydrogen 2.736 N/A GLY 10.A N.B THR 55.A OG1 no hydrogen 2.760 N/A THR 12.A N ILE 9.A O no hydrogen 3.006 N/A THR 12.A OG1 ASN 32.A OD1 no hydrogen 2.760 N/A VAL 13.A N GLY 31.A O no hydrogen 2.798 N/A VAL 14.A N ASN 7.A O no hydrogen 2.997 N/A ARG 15.A N ARG 28.A O no hydrogen 2.885 N/A ARG 15.A NE GLN 27.A OE1 no hydrogen 2.750 N/A ARG 15.A NH1 TYR 30.A OH no hydrogen 2.841 N/A ARG 15.A NH2 GLN 27.A OE1 no hydrogen 3.453 N/A LEU 19.A N ASP 23.A O no hydrogen 2.835 N/A GLN 21.A NE2 GLN 149.A OE1 no hydrogen 3.236 N/A GLY 22.A N LEU 19.A O no hydrogen 2.940 N/A ALA 25.A N VAL 17B.A O no hydrogen 2.928 N/A ARG 26.A NE ASP 29.A OD1 no hydrogen 2.677 N/A ARG 26.A NH2 ASP 29.A OD1 no hydrogen 3.241 N/A ARG 26.A NH2 ASP 29.A OD2 no hydrogen 3.559 N/A GLN 27.A N ARG 15.A O no hydrogen 2.682 N/A TYR 30.A N VAL 13.A O no hydrogen 2.682 N/A ARG 37.A N ASP 33.A O no hydrogen 3.365 N/A ARG 37.A NE ASP 33.A OD1 no hydrogen 2.997 N/A LEU 38.A N PRO 34.A O no hydrogen 2.828 N/A GLN 39.A N LEU 35.A O no hydrogen 2.834 N/A GLN 39.A NE2 GLY 74.A O no hydrogen 2.944 N/A ASP 40.A N PRO 36.A O no hydrogen 2.925 N/A TYR 41.A N ARG 37.A O no hydrogen 3.145 N/A ALA 42.A N LEU 38.A O no hydrogen 2.790 N/A ALA 43.A N GLN 39.A O no hydrogen 2.732 N/A GLN 44.A N ASP 40.A O no hydrogen 3.125 N/A GLN 44.A NE2 ASP 40.A O no hydrogen 3.562 N/A GLN 44.A NE2 ASP 40.A OD1 no hydrogen 2.846 N/A GLY 45.A N ALA 42.A O no hydrogen 2.926 N/A ALA 46.A N TYR 41.A O no hydrogen 3.292 N/A LEU 49.A N PRO 78.A O no hydrogen 3.039 N/A HIS 50.A N PRO 4.A O no hydrogen 2.918 N/A LEU 51.A N GLN 80.A O no hydrogen 2.864 N/A VAL 52.A N LEU 6.A O no hydrogen 2.940 N/A ASP 53.A N GLY 82.A O no hydrogen 2.933 N/A LEU 54.A N LEU 8.A O no hydrogen 2.884 N/A GLY 56.A N ASP 53.A OD1 no hydrogen 3.105 N/A ALA 57.A N ASP 53.A O no hydrogen 3.036 N/A LYS 58.A N LEU 54.A O no hydrogen 3.291 N/A LYS 58.A N THR 55.A O no hydrogen 3.247 N/A ASP 59.A N THR 55.A O no hydrogen 3.224 N/A ALA 61.A N ASP 59.A OD1 no hydrogen 3.150 N/A LYS 62.A N ASP 59.A O no hydrogen 2.683 N/A ARG 63.A N PRO 60.A O no hydrogen 3.217 N/A ARG 63.A NE ASP 90.A OD1 no hydrogen 2.974 N/A ARG 63.A NH1 ASP 53.A OD2 no hydrogen 3.457 N/A ARG 63.A NH1 GLY 83.A O no hydrogen 2.630 N/A ARG 63.A NH2 GLY 83.A O no hydrogen 2.982 N/A ARG 63.A NH2 GLY 84.A O no hydrogen 3.028 N/A ARG 63.A NH2 ASP 90.A OD1 no hydrogen 3.402 N/A ARG 63.A NH2 ASP 90.A OD2 no hydrogen 2.422 N/A GLN 64.A N ASP 53.A OD2 no hydrogen 2.961 N/A GLN 64.A NE2 GLY 10.A O.A no hydrogen 2.917 N/A GLN 64.A NE2 ASP 53.A OD1 no hydrogen 2.933 N/A ILE 65.A N ARG 63.A O no hydrogen 2.777 N/A ILE 68.A N GLN 64.A O no hydrogen 2.925 N/A LYS 69.A N ILE 65.A O no hydrogen 2.844 N/A THR 70.A N PRO 66.A O no hydrogen 3.192 N/A THR 70.A OG1 LEU 67.A O no hydrogen 2.754 N/A LEU 71.A N LEU 67.A O no hydrogen 2.970 N/A VAL 72.A N ILE 68.A O no hydrogen 2.946 N/A ALA 73.A N LYS 69.A O no hydrogen 3.036 N/A GLY 74.A N LEU 71.A O no hydrogen 3.105 N/A VAL 75.A N VAL 72.A O no hydrogen 3.236 N/A GLN 80.A N LEU 49.A O no hydrogen 2.764 N/A GLN 80.A NE2 HIS 50.A ND1 no hydrogen 2.934 N/A GLN 80.A NE2 GLN 203.A OE1 no hydrogen 2.841 N/A VAL 81.A N ARG 101.A O no hydrogen 3.100 N/A GLY 82.A N LEU 51.A O no hydrogen 3.009 N/A ARG 86.A NH1 ALA 57.A O no hydrogen 3.219 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.940 N/A ASP 90.A N THR 87.A OG1 no hydrogen 3.202 N/A VAL 91.A N THR 87.A O no hydrogen 3.217 N/A ALA 92.A N GLU 88.A O no hydrogen 2.876 N/A ALA 93.A N GLU 89.A O no hydrogen 2.938 N/A LEU 94.A N ASP 90.A O no hydrogen 3.170 N/A LEU 95.A N VAL 91.A O no hydrogen 3.007 N/A LYS 96.A N ALA 92.A O no hydrogen 2.841 N/A ALA 97.A N ALA 93.A O no hydrogen 3.107 N/A ALA 97.A N LEU 94.A O no hydrogen 3.058 N/A GLY 98.A N LEU 95.A O no hydrogen 2.920 N/A VAL 99.A N LEU 94.A O no hydrogen 3.166 N/A ALA 100.A N VAL 79.A O no hydrogen 2.900 N/A ARG 101.A N VAL 79.A O no hydrogen 3.497 N/A ARG 101.A NE GLN 80.A OE1 no hydrogen 2.996 N/A ARG 101.A NH2 GLN 80.A OE1 no hydrogen 3.034 N/A VAL 102.A N ALA 126.A O no hydrogen 2.792 N/A VAL 103.A N VAL 81.A O no hydrogen 2.866 N/A ILE 104.A N VAL 128.A O no hydrogen 2.729 N/A ALA 108.A N GLY 105.A O no hydrogen 3.061 N/A VAL 109.A N SER 106.A O no hydrogen 2.897 N/A LYS 110.A N SER 106.A O no hydrogen 2.967 N/A SER 111.A N THR 107.A O no hydrogen 2.802 N/A VAL 115.A N SER 111.A O no hydrogen 3.150 N/A LYS 116.A N PRO 112.A O no hydrogen 2.858 N/A GLY 117.A N ASP 113.A O no hydrogen 3.394 N/A PHE 119.A N VAL 115.A O no hydrogen 3.193 N/A GLU 120.A N LYS 116.A O no hydrogen 3.215 N/A ARG 121.A N GLY 117.A O no hydrogen 2.947 N/A ARG 121.A NH1 GLU 88.A OE1 no hydrogen 2.944 N/A PHE 122.A N TRP 118.A O no hydrogen 2.718 N/A GLY 123.A N PHE 119.A O no hydrogen 2.974 N/A ALA 126.A N GLY 123.A O no hydrogen 3.159 N/A LEU 127.A N ALA 124.A O no hydrogen 3.513 N/A VAL 128.A N VAL 102.A O no hydrogen 2.872 N/A LEU 129.A N HIS 170.A O no hydrogen 2.935 N/A ALA 130.A N ILE 104.A O no hydrogen 2.825 N/A LEU 131.A N LEU 172.A O no hydrogen 2.712 N/A VAL 133.A N THR 174.A O no hydrogen 2.783 N/A ARG 134.A N GLN 142.A O no hydrogen 2.929 N/A ASP 136.A N THR 140.A O no hydrogen 3.026 N/A HIS 138.A N ASP 136.A OD1 no hydrogen 2.782 N/A GLY 139.A N ASP 136.A O no hydrogen 2.966 N/A THR 140.A N ASP 136.A OD1 no hydrogen 3.024 N/A LYS 141.A NZ GLU 157.A OE2 no hydrogen 2.830 N/A LYS 141.A NZ GLU 192.A OE2 no hydrogen 2.705 N/A GLN 142.A N ARG 134.A O no hydrogen 2.951 N/A GLN 142.A NE2 ASP 136.A OD2 no hydrogen 3.079 N/A VAL 143.A N VAL 154.A O no hydrogen 2.848 N/A ALA 144.A N ASP 132.A O no hydrogen 2.642 N/A SER 146.A OG GLU 150.A OE2 no hydrogen 2.781 N/A TRP 148.A N HIS 20.A O no hydrogen 3.157 N/A GLN 149.A N SER 146.A O no hydrogen 3.430 N/A SER 152.A OG VAL 143.A O no hydrogen 2.240 N/A SER 152.A OG VAL 154.A O no hydrogen 3.477 N/A GLY 153.A N ASN 151.A OD1 no hydrogen 2.865 N/A LEU 156.A N LYS 141.A O no hydrogen 2.839 N/A GLU 157.A N GLU 157.A OE1 no hydrogen 2.794 N/A GLN 158.A N SER 155.A OG no hydrogen 3.060 N/A LEU 159.A N SER 155.A O no hydrogen 3.122 N/A VAL 160.A N LEU 156.A O no hydrogen 2.919 N/A GLU 161.A N GLU 157.A O no hydrogen 2.877 N/A THR 162.A N GLN 158.A O no hydrogen 2.971 N/A THR 162.A OG1 GLN 158.A O no hydrogen 2.733 N/A TYR 163.A N LEU 159.A O no hydrogen 3.348 N/A TYR 163.A N VAL 160.A O no hydrogen 3.190 N/A TYR 163.A OH ALA 108.A O no hydrogen 2.582 N/A LEU 164.A N VAL 160.A O no hydrogen 3.031 N/A VAL 166.A N TYR 163.A O no hydrogen 3.020 N/A GLY 167.A N LEU 164.A O no hydrogen 2.911 N/A LEU 168.A N TYR 163.A O no hydrogen 3.177 N/A LYS 169.A NZ GLN 199.A O no hydrogen 3.226 N/A HIS 170.A NE2 GLN 125.A OE1 no hydrogen 2.906 N/A VAL 171.A N ALA 201.A O no hydrogen 3.242 N/A LEU 172.A N LEU 129.A O no hydrogen 2.816 N/A CYS 173.A N GLN 203.A O no hydrogen 2.983 N/A THR 174.A N LEU 131.A O no hydrogen 3.022 N/A ILE 176.A N VAL 133.A O no hydrogen 2.988 N/A SER 177.A N ASP 175.A OD1 no hydrogen 3.010 N/A SER 177.A OG ASP 175.A OD1 no hydrogen 2.812 N/A ARG 178.A N ASP 175.A O no hydrogen 2.900 N/A ARG 178.A NH1 GLY 184.A O no hydrogen 3.072 N/A ASP 179.A N ASP 175.A O no hydrogen 3.151 N/A THR 181.A N ARG 178.A O no hydrogen 2.978 N/A THR 181.A OG1 ARG 178.A O no hydrogen 2.676 N/A GLY 184.A N GLY 207.A O no hydrogen 2.496 N/A SER 185.A OG GLY 206.A O no hydrogen 2.876 N/A ASN 186.A ND2 ASP 175.A OD2 no hydrogen 3.011 N/A SER 188.A OG ASN 186.A OD1 no hydrogen 3.389 N/A LEU 189.A N ASN 186.A OD1 no hydrogen 3.088 N/A TYR 190.A N ASN 186.A O no hydrogen 3.234 N/A TYR 190.A OH CYS 173.A O no hydrogen 2.655 N/A TYR 190.A OH SER 205.A O no hydrogen 3.311 N/A GLU 191.A N VAL 187.A O no hydrogen 2.930 N/A GLU 192.A N SER 188.A O no hydrogen 2.960 N/A VAL 193.A N LEU 189.A O no hydrogen 2.992 N/A CYS 194.A N TYR 190.A O no hydrogen 2.979 N/A CYS 194.A SG TYR 190.A O no hydrogen 3.183 N/A ALA 195.A N GLU 191.A O no hydrogen 3.281 N/A ARG 196.A N GLU 192.A O no hydrogen 2.960 N/A TYR 197.A N VAL 193.A O no hydrogen 2.961 N/A TYR 197.A OH GLU 161.A OE2 no hydrogen 2.717 N/A GLN 199.A N GLN 199.A OE1 no hydrogen 2.751 N/A ILE 200.A N TYR 197.A O no hydrogen 2.988 N/A ALA 201.A N LYS 169.A O no hydrogen 2.775 N/A GLN 203.A N VAL 171.A O no hydrogen 2.774 N/A GLN 203.A NE2 GLN 80.A OE1 no hydrogen 3.201 N/A SER 204.A N GLY 224.A O no hydrogen 2.843 N/A SER 204.A OG GLY 224.A O no hydrogen 3.457 N/A SER 205.A N TYR 190.A OH no hydrogen 3.249 N/A GLY 209.A N ASP 213.A OD2 no hydrogen 2.690 N/A ASP 210.A N ASP 213.A OD2 no hydrogen 3.063 N/A ASP 213.A N ASP 210.A O no hydrogen 2.994 N/A ASP 213.A N ASP 210.A OD1 no hydrogen 3.075 N/A ALA 215.A N ILE 211.A O no hydrogen 3.065 N/A ALA 216.A N ASP 212.A O no hydrogen 2.964 N/A LEU 217.A N ILE 214.A O no hydrogen 3.036 N/A ARG 218.A N ALA 215.A O no hydrogen 3.083 N/A ARG 218.A NH1 CYS 244.A O no hydrogen 2.790 N/A THR 220.A N LEU 217.A O no hydrogen 3.175 N/A THR 220.A OG1 LEU 217.A O no hydrogen 2.650 N/A VAL 222.A N THR 220.A OG1 no hydrogen 3.348 N/A ARG 223.A N PHE 202.A O no hydrogen 2.871 N/A GLY 224.A N PHE 202.A O no hydrogen 3.214 N/A VAL 225.A N MET 1.A O no hydrogen 2.760 N/A ILE 226.A N SER 204.A O no hydrogen 2.818 N/A VAL 227.A N ILE 3.A O no hydrogen 2.984 N/A ARG 229.A NE GLU 233.A OE2 no hydrogen 2.882 N/A ARG 229.A NH1 GLY 180.A O no hydrogen 3.362 N/A ARG 229.A NH2 GLU 233.A OE2 no hydrogen 2.976 N/A LEU 231.A N GLY 228.A O no hydrogen 3.214 N/A LEU 232.A N GLY 228.A O no hydrogen 3.254 N/A GLU 233.A N ARG 229.A O no hydrogen 2.719 N/A GLY 234.A N LEU 231.A O no hydrogen 3.170 N/A LYS 235.A N ALA 230.A O no hydrogen 2.876 N/A THR 237.A N GLU 240.A OE1 no hydrogen 2.923 N/A LYS 239.A N GLN 44.A OE1 no hydrogen 3.012 N/A GLU 240.A N THR 237.A OG1 no hydrogen 3.071 N/A ALA 241.A N THR 237.A O no hydrogen 2.925 N/A ILE 242.A N VAL 238.A O no hydrogen 2.912 N/A GLN 243.A N LYS 239.A O no hydrogen 2.931 N/A CYS 244.A N GLU 240.A O no hydrogen 2.967 N/A CYS 244.A SG ILE 211.A O no hydrogen 3.740 N/A TRP 245.A N ALA 241.A O no hydrogen 2.871 N/A GLN 246.A N ILE 242.A O no hydrogen 2.980 N/A VAL 17B.A N ALA 25.A O no hydrogen 2.806 N/A ARG 18C.A NH1 ASP 179.A OD2 no hydrogen 2.872 N/A ARG 18C.A NH2 ASP 132.A OD2 no hydrogen 3.535 N/A