Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5mkg_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N SER 4.A OG no hydrogen 3.214 N/A SER 1.A OG SER 4.A OG no hydrogen 3.427 N/A SER 4.A OG SER 1.A O no hydrogen 2.702 N/A SER 4.A OG SER 1.A OG no hydrogen 3.427 N/A GLU 5.A N SER 1.A O no hydrogen 3.174 N/A LEU 6.A N PRO 2.A O no hydrogen 3.081 N/A ARG 7.A N SER 3.A O no hydrogen 2.890 N/A ARG 8.A N SER 4.A O no hydrogen 2.898 N/A ALA 9.A N GLU 5.A O no hydrogen 3.050 N/A LEU 10.A N LEU 6.A O no hydrogen 2.929 N/A ALA 12.A N ARG 8.A O no hydrogen 2.907 N/A GLU 14.A N ALA 9.A O no hydrogen 2.798 N/A ILE 16.A N ARG 38.A O no hydrogen 2.877 N/A TYR 18.A N LEU 36.A O no hydrogen 2.789 N/A TYR 19.A N MET 235.A O no hydrogen 2.908 N/A TYR 19.A OH ASP 76.A OD2 no hydrogen 2.825 N/A GLN 20.A N GLU 34.A O no hydrogen 2.829 N/A GLN 20.A NE2 GLY 232.A O no hydrogen 3.234 N/A LEU 22.A N GLY 32.A O no hydrogen 2.907 N/A SER 23.A N LEU 226.A O no hydrogen 2.983 N/A SER 23.A OG PRO 24.A O no hydrogen 2.956 N/A GLY 25.A N ASP 224.A O no hydrogen 2.834 N/A GLN 26.A NE2 ALA 219.A O no hydrogen 2.953 N/A GLY 27.A N PRO 24.A O no hydrogen 2.825 N/A TRP 30.A N GLN 247.A OE1 no hydrogen 3.031 N/A ILE 31.A N LEU 22.A O no hydrogen 3.090 N/A VAL 33.A N HIS 89.A O no hydrogen 2.729 N/A GLU 34.A N GLN 20.A O no hydrogen 2.726 N/A VAL 35.A N GLY 91.A O no hydrogen 2.860 N/A LEU 36.A N TYR 18.A O no hydrogen 2.746 N/A ARG 38.A N ILE 16.A O no hydrogen 2.991 N/A ARG 38.A NH1 MET 37.A O no hydrogen 2.827 N/A TRP 39.A N ILE 47.A O no hydrogen 3.190 N/A TRP 39.A NE1 GLU 14.A OE1 no hydrogen 3.081 N/A ARG 40.A N GLU 14.A O no hydrogen 2.714 N/A HIS 41.A N GLY 45.A O no hydrogen 2.924 N/A HIS 41.A NE2 GLU 5.A OE2 no hydrogen 2.952 N/A GLY 45.A N HIS 41.A O no hydrogen 2.891 N/A ILE 47.A N TRP 39.A O no hydrogen 2.893 N/A LEU 51.A N ARG 48.A O no hydrogen 3.290 N/A PHE 52.A N PRO 49.A O no hydrogen 3.096 N/A ILE 53.A N PRO 49.A O no hydrogen 2.727 N/A ALA 56.A N PHE 52.A O no hydrogen 3.208 N/A GLU 57.A N ILE 53.A O no hydrogen 2.927 N/A ARG 58.A N PRO 54.A O no hydrogen 3.048 N/A SER 59.A N PHE 55.A O no hydrogen 2.868 N/A SER 59.A OG PHE 55.A O no hydrogen 3.015 N/A SER 59.A OG ALA 56.A O no hydrogen 3.466 N/A GLY 60.A N GLU 57.A O no hydrogen 3.368 N/A LEU 61.A N SER 59.A OG no hydrogen 3.254 N/A ILE 62.A N ALA 56.A O no hydrogen 2.971 N/A MET 65.A N LEU 61.A O no hydrogen 3.191 N/A THR 66.A N ILE 62.A O no hydrogen 2.715 N/A THR 66.A OG1 ILE 62.A O no hydrogen 2.838 N/A ARG 67.A N VAL 63.A O no hydrogen 3.208 N/A ALA 68.A N PRO 64.A O no hydrogen 2.799 N/A LEU 69.A N MET 65.A O no hydrogen 2.957 N/A MET 70.A N THR 66.A O no hydrogen 2.898 N/A ARG 71.A N ARG 67.A O no hydrogen 3.060 N/A GLN 72.A N ALA 68.A O no hydrogen 3.034 N/A GLN 72.A NE2 GLN 72.A O no hydrogen 3.273 N/A GLN 72.A NE2 ASP 76.A OD1 no hydrogen 2.740 N/A VAL 73.A N LEU 69.A O no hydrogen 2.909 N/A ALA 74.A N MET 70.A O no hydrogen 3.187 N/A GLU 75.A N ARG 71.A O no hydrogen 3.030 N/A ASP 76.A N GLN 72.A O no hydrogen 2.759 N/A LEU 77.A N VAL 73.A O no hydrogen 2.791 N/A GLY 78.A N ALA 74.A O no hydrogen 2.783 N/A HIS 80.A N LEU 77.A O no hydrogen 3.193 N/A LYS 83.A N HIS 80.A O no hydrogen 3.029 N/A LEU 84.A N ALA 81.A O no hydrogen 3.018 N/A GLY 87.A N HIS 119.A O no hydrogen 2.811 N/A PHE 88.A N HIS 119.A O no hydrogen 3.241 N/A HIS 89.A N ILE 31.A O no hydrogen 2.869 N/A HIS 89.A ND1 GLY 87.A O no hydrogen 2.832 N/A ILE 90.A N THR 121.A O no hydrogen 2.846 N/A GLY 91.A N VAL 33.A O no hydrogen 2.868 N/A PHE 92.A N VAL 123.A O no hydrogen 2.967 N/A ASN 93.A ND2 GLU 34.A OE2 no hydrogen 3.016 N/A ASN 93.A ND2 VAL 35.A O no hydrogen 3.301 N/A ILE 94.A N GLU 125.A O no hydrogen 3.191 N/A SER 95.A OG GLU 57.A OE2 no hydrogen 3.019 N/A CYS 99.A N ALA 96.A O no hydrogen 3.024 N/A CYS 99.A SG SER 95.A O no hydrogen 3.661 N/A GLU 101.A N HIS 98.A O no hydrogen 3.292 N/A VAL 105.A N LEU 102.A O no hydrogen 3.328 N/A ASP 106.A N ALA 103.A O no hydrogen 2.524 N/A ASP 107.A N ALA 103.A O no hydrogen 3.369 N/A CYS 108.A N LEU 104.A O no hydrogen 3.001 N/A CYS 108.A SG LEU 104.A O no hydrogen 3.225 N/A ARG 109.A N VAL 105.A O no hydrogen 3.009 N/A ARG 109.A NH1 ASP 106.A OD1 no hydrogen 3.504 N/A GLU 110.A N ASP 106.A O no hydrogen 2.843 N/A LEU 111.A N ASP 107.A O no hydrogen 3.007 N/A LEU 112.A N CYS 108.A O no hydrogen 2.867 N/A ALA 113.A N ARG 109.A O no hydrogen 2.955 N/A ALA 114.A N GLU 110.A O no hydrogen 3.247 N/A ALA 114.A N LEU 111.A O no hydrogen 3.065 N/A PHE 115.A N LEU 112.A O no hydrogen 3.218 N/A HIS 119.A N PRO 116.A O no hydrogen 2.990 N/A HIS 119.A NE2 ALA 81.A O no hydrogen 2.860 N/A THR 121.A N PHE 88.A O no hydrogen 2.842 N/A THR 121.A OG1 GLY 87.A O no hydrogen 3.177 N/A VAL 123.A N ILE 90.A O no hydrogen 2.950 N/A LEU 124.A N LYS 151.A O no hydrogen 2.980 N/A GLU 125.A N PHE 92.A O no hydrogen 2.970 N/A LEU 126.A N ALA 153.A O no hydrogen 2.868 N/A LEU 131.A N GLU 128.A O no hydrogen 2.991 N/A ILE 132.A N GLU 128.A O no hydrogen 2.801 N/A SER 134.A OG THR 138.A OG1 no hydrogen 2.369 N/A THR 138.A OG1 SER 134.A OG no hydrogen 2.369 N/A THR 138.A OG1 SER 135.A O no hydrogen 2.496 N/A THR 138.A OG1 ASP 139.A OD1 no hydrogen 3.537 N/A ASP 139.A N SER 135.A O no hydrogen 3.168 N/A ARG 140.A N GLU 136.A O no hydrogen 3.249 N/A LEU 141.A N VAL 137.A O no hydrogen 3.002 N/A PHE 142.A N THR 138.A O no hydrogen 2.766 N/A ASP 143.A N ASP 139.A O no hydrogen 3.171 N/A GLU 144.A N ARG 140.A O no hydrogen 2.771 N/A LEU 145.A N LEU 141.A O no hydrogen 2.839 N/A HIS 146.A N PHE 142.A O no hydrogen 2.847 N/A HIS 146.A ND1 VAL 150.A O no hydrogen 2.941 N/A HIS 146.A NE2 GLN 166.A O no hydrogen 3.165 N/A ALA 147.A N ASP 143.A O no hydrogen 3.000 N/A LEU 148.A N GLU 144.A O no hydrogen 3.329 N/A LEU 148.A N LEU 145.A O no hydrogen 3.108 N/A GLY 149.A N HIS 146.A O no hydrogen 2.839 N/A VAL 150.A N LEU 145.A O no hydrogen 3.100 N/A LYS 151.A N LEU 122.A O no hydrogen 2.912 N/A LYS 151.A NZ GLY 149.A O no hydrogen 3.432 N/A ILE 152.A N ASP 168.A OD2 no hydrogen 2.914 N/A ALA 153.A N LEU 124.A O no hydrogen 2.739 N/A ILE 154.A N CYS 169.A O no hydrogen 2.906 N/A ASP 155.A N LEU 126.A O no hydrogen 2.575 N/A ASP 156.A N ASP 155.A OD1 no hydrogen 2.871 N/A PHE 157.A N LYS 171.A O no hydrogen 2.790 N/A THR 159.A N ASP 156.A O no hydrogen 3.452 N/A THR 159.A OG1 ASP 156.A O no hydrogen 2.689 N/A TYR 161.A OH GLU 128.A OE1 no hydrogen 2.756 N/A LEU 162.A N ALA 160.A O no hydrogen 2.482 N/A LYS 164.A N TYR 161.A O no hydrogen 2.734 N/A ASP 168.A N ILE 152.A O no hydrogen 2.916 N/A CYS 169.A SG LEU 170.A O no hydrogen 3.728 N/A CYS 169.A SG ASP 203.A O no hydrogen 3.490 N/A LEU 170.A N ASP 203.A O no hydrogen 2.881 N/A LYS 171.A N ILE 154.A O no hydrogen 2.866 N/A LYS 171.A NZ GLU 125.A OE1 no hydrogen 3.117 N/A LYS 171.A NZ GLU 125.A OE2 no hydrogen 2.910 N/A LYS 171.A NZ GLU 207.A OE2 no hydrogen 3.180 N/A LYS 171.A NZ GLN 227.A OE1 no hydrogen 2.995 N/A ILE 172.A N VAL 205.A O no hydrogen 2.717 N/A ASP 173.A N PHE 157.A O no hydrogen 3.493 N/A SER 175.A N ASP 173.A OD2 no hydrogen 3.057 N/A SER 175.A OG ASP 173.A OD2 no hydrogen 2.765 N/A PHE 176.A N ASP 173.A O no hydrogen 3.182 N/A ALA 178.A N GLN 174.A O no hydrogen 2.786 N/A ARG 179.A N PHE 176.A O no hydrogen 3.351 N/A ILE 180.A N VAL 177.A O no hydrogen 3.239 N/A ILE 182.A N ARG 179.A O no hydrogen 3.294 N/A SER 186.A OG ASP 183.A O no hydrogen 3.027 N/A GLY 187.A N ASP 183.A O no hydrogen 3.045 N/A HIS 188.A N THR 184.A O no hydrogen 2.852 N/A ILE 189.A N LEU 185.A O no hydrogen 2.990 N/A LEU 190.A N SER 186.A O no hydrogen 2.858 N/A ASP 191.A N GLY 187.A O no hydrogen 2.950 N/A SER 192.A N HIS 188.A O no hydrogen 2.985 N/A ILE 193.A N ILE 189.A O no hydrogen 3.013 N/A VAL 194.A N LEU 190.A O no hydrogen 3.112 N/A GLU 195.A N ASP 191.A O no hydrogen 3.017 N/A LEU 196.A N SER 192.A O no hydrogen 2.801 N/A SER 197.A N ILE 193.A O no hydrogen 3.018 N/A SER 197.A OG VAL 194.A O no hydrogen 2.532 N/A ALA 198.A N VAL 194.A O no hydrogen 3.295 N/A LYS 199.A N GLU 195.A O no hydrogen 3.032 N/A LEU 200.A N LEU 196.A O no hydrogen 2.954 N/A ASP 201.A N ALA 198.A O no hydrogen 3.352 N/A LEU 202.A N SER 197.A O no hydrogen 2.875 N/A ASP 203.A N ASP 168.A O no hydrogen 3.043 N/A ILE 204.A N ASP 224.A OD2 no hydrogen 3.008 N/A VAL 205.A N LEU 170.A O no hydrogen 2.914 N/A ALA 206.A N TYR 225.A O no hydrogen 2.961 N/A GLU 207.A N ILE 172.A O no hydrogen 3.108 N/A VAL 209.A N GLN 227.A O no hydrogen 2.937 N/A GLU 210.A N GLN 214.A OE1 no hydrogen 2.733 N/A THR 211.A N GLN 214.A OE1 no hydrogen 3.020 N/A GLN 214.A N THR 211.A OG1 no hydrogen 3.142 N/A ARG 215.A N THR 211.A O no hydrogen 3.204 N/A ARG 215.A NE ASP 216.A OD1 no hydrogen 3.331 N/A ARG 215.A NH2 ASP 216.A OD1 no hydrogen 3.366 N/A ASP 216.A N PRO 212.A O no hydrogen 3.018 N/A TYR 217.A N GLU 213.A O no hydrogen 3.088 N/A TYR 217.A OH ASP 191.A OD1 no hydrogen 3.175 N/A LEU 218.A N GLN 214.A O no hydrogen 3.124 N/A ALA 219.A N ARG 215.A O no hydrogen 2.878 N/A ALA 220.A N ASP 216.A O no hydrogen 2.891 N/A ARG 221.A N LEU 218.A O no hydrogen 3.332 N/A ARG 221.A NH1 TYR 217.A O no hydrogen 2.836 N/A GLY 222.A N ALA 219.A O no hydrogen 2.960 N/A VAL 223.A N LEU 218.A O no hydrogen 3.155 N/A TYR 225.A N ILE 204.A O no hydrogen 3.223 N/A LEU 226.A N SER 23.A O no hydrogen 2.704 N/A GLN 227.A N ALA 206.A O no hydrogen 2.913 N/A GLN 227.A NE2 GLN 20.A OE1 no hydrogen 2.745 N/A GLN 227.A NE2 GLU 34.A OE1 no hydrogen 2.505 N/A LEU 230.A N VAL 209.A O no hydrogen 2.993 N/A ILE 231.A N GLY 228.A O no hydrogen 2.994 N/A GLY 232.A N GLY 228.A O no hydrogen 2.760 N/A MET 235.A N TYR 19.A O no hydrogen 3.060 N/A SER 239.A OG GLU 238.A OE2 no hydrogen 3.400 N/A LEU 240.A N PRO 236.A O no hydrogen 3.280 N/A LEU 241.A N LEU 237.A O no hydrogen 2.973 N/A SER 242.A N GLU 238.A O no hydrogen 2.834 N/A SER 242.A OG GLU 238.A O no hydrogen 2.704 N/A SER 243.A N SER 239.A O no hydrogen 2.961 N/A SER 243.A OG SER 239.A O no hydrogen 2.711 N/A LEU 244.A N LEU 240.A O no hydrogen 2.846 N/A THR 245.A N LEU 241.A O no hydrogen 2.906 N/A THR 245.A OG1 LEU 241.A O no hydrogen 2.815 N/A VAL 246.A N SER 242.A O no hydrogen 3.159 N/A GLN 247.A N SER 243.A O no hydrogen 3.144 N/A GLU 248.A N LEU 244.A O no hydrogen 3.153 N/A GLU 248.A N THR 245.A O no hydrogen 3.197 N/A GLY 249.A N VAL 246.A O no hydrogen 2.997 N/A