Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p68_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N ALA 30.A O no hydrogen 2.810 N/A LYS 8.A N LEU 5.A O no hydrogen 2.978 N/A VAL 9.A N ASP 87.A OD2 no hydrogen 2.772 N/A SER 10.A N THR 33.A O no hydrogen 2.915 N/A SER 10.A OG SER 32.A OG no hydrogen 2.645 N/A LEU 11.A N ILE 88.A O no hydrogen 2.839 N/A VAL 12.A N ILE 35.A O no hydrogen 3.061 N/A THR 13.A N VAL 90.A O no hydrogen 3.137 N/A THR 13.A OG1 VAL 90.A O no hydrogen 3.509 N/A GLY 14.A N THR 37.A OG1 no hydrogen 2.947 N/A SER 15.A N THR 37.A O no hydrogen 2.940 N/A SER 15.A OG VAL 12.A O no hydrogen 2.629 N/A ARG 17.A NH2 ASP 193.A OD1 no hydrogen 2.671 N/A ARG 21.A N ARG 17.A O no hydrogen 3.143 N/A ARG 21.A NE GLU 25.A OE2 no hydrogen 2.846 N/A ARG 21.A NH1 GLU 50.A OE1 no hydrogen 3.354 N/A ARG 21.A NH2 GLU 50.A OE1 no hydrogen 2.836 N/A ALA 22.A N GLY 18.A O no hydrogen 3.078 N/A ILE 23.A N ILE 19.A O no hydrogen 2.851 N/A ALA 24.A N GLY 20.A O no hydrogen 3.024 N/A GLU 25.A N ARG 21.A O no hydrogen 2.889 N/A LYS 26.A N ALA 22.A O no hydrogen 2.889 N/A LYS 26.A NZ GLU 219.A OE2 no hydrogen 2.483 N/A LYS 26.A NZ ASN 223.A OD1 no hydrogen 2.950 N/A LEU 27.A N ILE 23.A O no hydrogen 2.979 N/A ALA 28.A N ALA 24.A O no hydrogen 2.899 N/A SER 29.A N GLU 25.A O no hydrogen 2.751 N/A SER 29.A OG LYS 26.A O no hydrogen 2.535 N/A ALA 30.A N LYS 26.A O no hydrogen 3.152 N/A ALA 30.A N LEU 27.A O no hydrogen 3.055 N/A GLY 31.A N ALA 28.A O no hydrogen 2.837 N/A SER 32.A N LEU 27.A O no hydrogen 3.074 N/A SER 32.A OG LYS 8.A O no hydrogen 3.519 N/A SER 32.A OG SER 10.A OG no hydrogen 2.645 N/A SER 32.A OG THR 33.A O no hydrogen 2.747 N/A THR 33.A N LYS 8.A O no hydrogen 3.019 N/A VAL 34.A N LYS 58.A O no hydrogen 3.067 N/A ILE 35.A N SER 10.A O no hydrogen 2.811 N/A ILE 36.A N HIS 60.A O no hydrogen 2.834 N/A THR 37.A N SER 15.A OG no hydrogen 3.208 N/A GLY 38.A N VAL 62.A O no hydrogen 3.411 N/A SER 40.A OG GLU 42.A OE1 no hydrogen 3.349 N/A GLY 41.A N GLU 63.A OE1 no hydrogen 2.979 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.913 N/A ARG 43.A N SER 40.A OG no hydrogen 3.085 N/A ALA 44.A N SER 40.A O no hydrogen 2.968 N/A LYS 45.A N GLY 41.A O no hydrogen 2.884 N/A LYS 45.A NZ GLY 61.A O no hydrogen 2.737 N/A LYS 45.A NZ GLU 78.A OE2 no hydrogen 2.967 N/A ALA 46.A N GLU 42.A O no hydrogen 2.949 N/A VAL 47.A N ARG 43.A O no hydrogen 2.843 N/A ALA 48.A N ALA 44.A O no hydrogen 2.981 N/A GLU 49.A N LYS 45.A O no hydrogen 3.020 N/A GLU 50.A N ALA 46.A O no hydrogen 3.055 N/A ILE 51.A N VAL 47.A O no hydrogen 2.898 N/A ALA 52.A N ALA 48.A O no hydrogen 2.801 N/A ASN 53.A N GLU 49.A O no hydrogen 2.995 N/A LYS 54.A N GLU 50.A O no hydrogen 3.011 N/A LYS 54.A NZ GLU 25.A OE1 no hydrogen 2.965 N/A TYR 55.A N ILE 51.A O no hydrogen 2.921 N/A TYR 55.A OH GLU 25.A OE1 no hydrogen 2.798 N/A GLY 56.A N ALA 52.A O no hydrogen 2.746 N/A LYS 58.A NZ HIS 60.A NE2 no hydrogen 2.862 N/A LYS 58.A NZ LEU 82.A O no hydrogen 3.242 N/A HIS 60.A N VAL 34.A O no hydrogen 3.027 N/A VAL 62.A N ILE 36.A O no hydrogen 2.880 N/A MET 64.A N GLY 38.A O no hydrogen 2.767 N/A ASN 65.A N SER 71.A OG no hydrogen 2.791 N/A LEU 67.A N ASN 65.A OD1 no hydrogen 2.911 N/A SER 68.A N ASN 65.A O no hydrogen 2.860 N/A SER 71.A N SER 68.A OG no hydrogen 2.962 N/A ILE 72.A N SER 68.A O no hydrogen 3.040 N/A ASN 73.A N GLU 69.A O no hydrogen 2.892 N/A LYS 74.A N GLU 70.A O no hydrogen 3.004 N/A ALA 75.A N SER 71.A O no hydrogen 2.870 N/A PHE 76.A N ILE 72.A O no hydrogen 3.003 N/A GLU 77.A N ASN 73.A O no hydrogen 3.065 N/A GLU 78.A N LYS 74.A O no hydrogen 3.237 N/A ILE 79.A N ALA 75.A O no hydrogen 2.905 N/A TYR 80.A N PHE 76.A O no hydrogen 2.861 N/A TYR 80.A OH ASN 126.A O no hydrogen 2.556 N/A ASN 81.A N GLU 78.A O no hydrogen 3.278 N/A LEU 82.A N ILE 79.A O no hydrogen 2.859 N/A VAL 83.A N ILE 79.A O no hydrogen 2.925 N/A ASP 87.A N VAL 9.A O no hydrogen 2.943 N/A ILE 88.A N VAL 9.A O no hydrogen 3.081 N/A LEU 89.A N ARG 138.A O no hydrogen 2.897 N/A VAL 90.A N LEU 11.A O no hydrogen 2.846 N/A ASN 91.A N VAL 140.A O no hydrogen 2.847 N/A ASN 91.A ND2 THR 124.A OG1 no hydrogen 2.918 N/A ASN 91.A ND2 ASN 141.A OD1 no hydrogen 2.861 N/A ASN 92.A N THR 13.A OG1 no hydrogen 3.098 N/A ASN 92.A ND2 THR 13.A O no hydrogen 3.176 N/A ASN 92.A ND2 GLY 14.A O no hydrogen 3.063 N/A ALA 93.A N THR 13.A OG1 no hydrogen 2.979 N/A ILE 95.A N ASN 116.A OD1 no hydrogen 2.896 N/A ARG 97.A NE GLU 111.A OE1 no hydrogen 2.858 N/A ARG 97.A NH1 THR 96.A O no hydrogen 2.961 N/A LYS 99.A N GLY 153.A O no hydrogen 3.126 N/A ARG 103.A N LEU 100.A O no hydrogen 2.818 N/A MET 104.A N PHE 101.A O no hydrogen 3.131 N/A SER 105.A N ASP 108.A OD2 no hydrogen 3.053 N/A ASP 108.A N SER 105.A OG no hydrogen 2.998 N/A TRP 109.A N SER 105.A O no hydrogen 3.083 N/A GLU 110.A N LEU 106.A O no hydrogen 2.770 N/A GLU 111.A N LEU 107.A O no hydrogen 2.916 N/A LEU 113.A N TRP 109.A O no hydrogen 3.185 N/A LYS 114.A N GLU 110.A O no hydrogen 2.758 N/A VAL 115.A N GLU 111.A O no hydrogen 2.975 N/A ASN 116.A N VAL 112.A O no hydrogen 2.933 N/A ASN 116.A ND2 ILE 95.A O no hydrogen 3.090 N/A ASN 116.A ND2 THR 160.A OG1 no hydrogen 3.041 N/A LEU 117.A N LEU 113.A O no hydrogen 3.017 N/A THR 118.A N LEU 113.A O no hydrogen 3.077 N/A GLY 119.A N LYS 114.A O no hydrogen 2.766 N/A THR 120.A OG1 ASN 116.A O no hydrogen 2.859 N/A PHE 121.A N LEU 117.A O no hydrogen 2.864 N/A LEU 122.A N THR 118.A O no hydrogen 2.847 N/A VAL 123.A N GLY 119.A O no hydrogen 2.865 N/A THR 124.A N THR 120.A O no hydrogen 2.902 N/A THR 124.A OG1 THR 120.A O no hydrogen 2.794 N/A GLN 125.A N PHE 121.A O no hydrogen 2.963 N/A ASN 126.A N LEU 122.A O no hydrogen 3.026 N/A ASN 126.A ND2 ASN 73.A OD1 no hydrogen 3.012 N/A ASN 126.A ND2 LEU 122.A O no hydrogen 2.898 N/A SER 127.A N THR 124.A O no hydrogen 3.010 N/A SER 127.A OG VAL 123.A O no hydrogen 2.756 N/A LYS 130.A NZ ASP 87.A OD1 no hydrogen 2.701 N/A LYS 130.A NZ GLN 134.A OE1 no hydrogen 2.890 N/A ILE 132.A N LEU 128.A O no hydrogen 2.939 N/A LYS 133.A N ARG 129.A O no hydrogen 3.133 N/A GLN 134.A N LYS 130.A O no hydrogen 3.017 N/A GLN 134.A NE2 ASP 87.A OD1 no hydrogen 2.855 N/A GLN 134.A NE2 TRP 136.A O no hydrogen 2.873 N/A ARG 135.A N ILE 132.A O no hydrogen 3.375 N/A TRP 136.A N MET 131.A O no hydrogen 3.153 N/A ARG 138.A N ASP 87.A O no hydrogen 3.192 N/A ARG 138.A NH1 LEU 228.A O no hydrogen 3.003 N/A ARG 138.A NH1 SER 230.A O no hydrogen 2.769 N/A ILE 139.A N LEU 181.A O no hydrogen 2.847 N/A VAL 140.A N LEU 89.A O no hydrogen 2.755 N/A ASN 141.A N ASN 183.A O no hydrogen 2.830 N/A ASN 141.A ND2 THR 168.A OG1 no hydrogen 2.921 N/A ILE 142.A N ASN 91.A O no hydrogen 3.041 N/A SER 143.A N VAL 185.A O no hydrogen 2.736 N/A SER 143.A OG LYS 161.A O no hydrogen 2.702 N/A VAL 145.A N PRO 187.A O no hydrogen 2.951 N/A VAL 146.A N SER 144.A OG no hydrogen 3.107 N/A GLY 147.A N SER 144.A O no hydrogen 2.918 N/A PHE 148.A N VAL 145.A O no hydrogen 2.950 N/A THR 149.A N VAL 145.A O no hydrogen 3.037 N/A THR 149.A OG1 VAL 145.A O no hydrogen 3.365 N/A THR 149.A OG1 GLY 150.A O no hydrogen 2.754 N/A GLY 150.A N VAL 146.A O no hydrogen 2.868 N/A ASN 151.A ND2 GLN 154.A OE1 no hydrogen 2.788 N/A GLN 154.A N ASN 151.A O no hydrogen 3.014 N/A GLN 154.A NE2 ASP 98.A OD1 no hydrogen 2.964 N/A GLN 154.A NE2 ASP 98.A OD2 no hydrogen 3.544 N/A ASN 156.A ND2 ARG 97.A O no hydrogen 2.894 N/A ASN 156.A ND2 ASP 108.A O no hydrogen 3.179 N/A TYR 157.A N ASN 156.A OD1 no hydrogen 2.818 N/A SER 158.A N GLN 154.A O no hydrogen 2.716 N/A SER 158.A OG VAL 146.A O no hydrogen 2.791 N/A THR 159.A N VAL 155.A O no hydrogen 3.001 N/A THR 159.A OG1 VAL 155.A O no hydrogen 2.677 N/A THR 160.A N ASN 156.A O no hydrogen 3.197 N/A THR 160.A OG1 TYR 157.A O no hydrogen 2.735 N/A LYS 161.A N TYR 157.A O no hydrogen 2.945 N/A LYS 161.A NZ ILE 142.A O no hydrogen 2.742 N/A ALA 162.A N SER 158.A O no hydrogen 2.906 N/A GLY 163.A N THR 159.A O no hydrogen 2.830 N/A LEU 164.A N THR 160.A O no hydrogen 2.889 N/A ILE 165.A N ALA 162.A O no hydrogen 2.866 N/A PHE 167.A N GLY 163.A O no hydrogen 2.958 N/A THR 168.A N LEU 164.A O no hydrogen 2.881 N/A THR 168.A OG1 LEU 164.A O no hydrogen 2.660 N/A LYS 169.A N ILE 165.A O no hydrogen 2.914 N/A LYS 169.A NZ GLY 238.A O no hydrogen 2.578 N/A SER 170.A N GLY 166.A O no hydrogen 2.999 N/A SER 170.A OG GLY 166.A O no hydrogen 3.225 N/A LEU 171.A N PHE 167.A O no hydrogen 2.964 N/A ALA 172.A N THR 168.A O no hydrogen 2.918 N/A LYS 173.A N LYS 169.A O no hydrogen 3.293 N/A GLU 174.A N SER 170.A O no hydrogen 3.135 N/A LEU 175.A N LEU 171.A O no hydrogen 2.979 N/A ARG 178.A N LEU 175.A O no hydrogen 2.905 N/A ARG 178.A NE ILE 132.A O no hydrogen 3.009 N/A ARG 178.A NH2 ILE 132.A O no hydrogen 2.520 N/A ASN 179.A N ALA 176.A O no hydrogen 2.903 N/A ASN 179.A ND2 ARG 135.A O no hydrogen 3.087 N/A VAL 180.A N LEU 175.A O no hydrogen 3.382 N/A LEU 181.A N GLY 137.A O no hydrogen 2.882 N/A VAL 182.A N THR 237.A OG1 no hydrogen 3.010 N/A ASN 183.A N ILE 139.A O no hydrogen 2.945 N/A ASN 183.A ND2 ILE 236.A O no hydrogen 2.911 N/A ALA 184.A N GLU 239.A O no hydrogen 2.819 N/A VAL 185.A N ASN 141.A O no hydrogen 2.939 N/A ALA 186.A N ILE 241.A O no hydrogen 2.859 N/A GLY 188.A N VAL 243.A O no hydrogen 2.945 N/A GLU 191.A N GLY 216.A O no hydrogen 2.851 N/A THR 192.A N THR 195.A OG1 no hydrogen 2.974 N/A THR 195.A N THR 192.A O no hydrogen 3.005 N/A THR 195.A OG1 THR 192.A O no hydrogen 3.194 N/A ALA 196.A N ASP 193.A O no hydrogen 3.265 N/A VAL 197.A N MET 194.A O no hydrogen 3.201 N/A LEU 198.A N THR 195.A O no hydrogen 3.071 N/A ILE 202.A N SER 199.A OG no hydrogen 3.208 N/A LYS 203.A N SER 199.A O no hydrogen 2.976 N/A GLN 204.A N GLU 200.A O no hydrogen 3.014 N/A LYS 205.A N GLU 201.A O no hydrogen 2.925 N/A TYR 206.A N ILE 202.A O no hydrogen 2.863 N/A LYS 207.A N LYS 203.A O no hydrogen 3.070 N/A GLU 208.A N GLN 204.A O no hydrogen 3.025 N/A GLN 209.A N TYR 206.A O no hydrogen 2.837 N/A ILE 210.A N LYS 207.A O no hydrogen 3.095 N/A LEU 212.A N GLY 245.A O no hydrogen 3.167 N/A GLY 213.A N ILE 210.A O no hydrogen 2.688 N/A ARG 214.A NH1 PHE 215.A O no hydrogen 3.320 N/A ARG 214.A NH1 GLU 220.A OE1 no hydrogen 2.864 N/A ARG 214.A NH1 GLU 220.A OE2 no hydrogen 3.455 N/A ARG 214.A NH2 GLU 220.A OE2 no hydrogen 2.869 N/A GLY 216.A N PHE 189.A O no hydrogen 3.052 N/A SER 217.A N GLU 220.A OE1 no hydrogen 2.907 N/A GLU 220.A N SER 217.A OG no hydrogen 3.122 N/A VAL 221.A N SER 217.A O no hydrogen 3.377 N/A ALA 222.A N PRO 218.A O no hydrogen 2.945 N/A ASN 223.A N GLU 219.A O no hydrogen 2.807 N/A VAL 224.A N VAL 221.A O no hydrogen 3.015 N/A VAL 225.A N VAL 221.A O no hydrogen 3.202 N/A LEU 226.A N ALA 222.A O no hydrogen 2.895 N/A PHE 227.A N ASN 223.A O no hydrogen 3.073 N/A LEU 228.A N VAL 224.A O no hydrogen 3.084 N/A CYS 229.A N VAL 225.A O no hydrogen 3.048 N/A CYS 229.A N LEU 226.A O no hydrogen 2.961 N/A CYS 229.A SG VAL 225.A O no hydrogen 3.361 N/A SER 230.A N PHE 227.A O no hydrogen 3.005 N/A SER 230.A OG PHE 227.A O no hydrogen 2.621 N/A LEU 232.A N SER 230.A OG no hydrogen 3.118 N/A ALA 233.A N SER 230.A O no hydrogen 3.293 N/A ILE 236.A N ALA 233.A O no hydrogen 3.143 N/A THR 237.A OG1 VAL 182.A O no hydrogen 3.491 N/A GLY 238.A N VAL 182.A O no hydrogen 2.815 N/A GLU 239.A N ASN 183.A OD1 no hydrogen 2.905 N/A VAL 240.A N GLU 239.A OE1 no hydrogen 2.907 N/A ILE 241.A N ALA 184.A O no hydrogen 2.843 N/A VAL 243.A N ALA 186.A O no hydrogen 2.979 N/A GLY 246.A N ASN 244.A OD1 no hydrogen 2.942 N/A MET 247.A N ASN 244.A O no hydrogen 3.442 N/A PHE 248.A N ASN 244.A OD1 no hydrogen 3.417 N/A