Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a2x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N GLU 9.A OE1 no hydrogen 3.016 N/A GLY 8.A N ILE 136.A O no hydrogen 2.878 N/A GLU 9.A N LEU 6.A O no hydrogen 3.026 N/A ARG 10.A NH1 GLU 13.A OE2 no hydrogen 3.036 N/A PHE 11.A N GLY 134.A O no hydrogen 2.680 N/A MET 14.A N LEU 25.A O no hydrogen 3.101 N/A VAL 16.A N ILE 23.A O no hydrogen 2.719 N/A THR 18.A N GLY 21.A O no hydrogen 2.824 N/A THR 18.A OG1 GLY 21.A O no hydrogen 2.547 N/A ASP 19.A N ILE 100.A O no hydrogen 3.121 N/A HIS 20.A N THR 18.A OG1 no hydrogen 2.804 N/A GLY 21.A N THR 18.A O no hydrogen 2.847 N/A ILE 23.A N VAL 16.A O no hydrogen 2.831 N/A LEU 25.A N MET 14.A O no hydrogen 2.774 N/A HIS 28.A N LYS 24.A O no hydrogen 2.824 N/A TYR 29.A N PRO 26.A O no hydrogen 2.953 N/A VAL 30.A N PRO 26.A O no hydrogen 3.100 N/A SER 31.A N ASP 27.A O no hydrogen 2.952 N/A SER 31.A OG ASP 27.A O no hydrogen 3.006 N/A SER 31.A OG HIS 28.A O no hydrogen 3.270 N/A GLN 32.A N TYR 29.A O no hydrogen 2.978 N/A GLN 32.A NE2 HIS 28.A O no hydrogen 2.900 N/A GLY 33.A N VAL 30.A O no hydrogen 2.918 N/A LYS 34.A N TYR 29.A O no hydrogen 2.901 N/A TRP 35.A N GLY 67.A O no hydrogen 3.048 N/A PHE 36.A N VAL 130.A O no hydrogen 2.920 N/A VAL 37.A N ASP 69.A O no hydrogen 2.908 N/A LEU 38.A N PHE 128.A O no hydrogen 2.966 N/A PHE 39.A N ILE 71.A O no hydrogen 2.987 N/A SER 40.A N GLY 126.A O no hydrogen 2.859 N/A SER 40.A OG VAL 124.A O no hydrogen 2.579 N/A HIS 41.A N LEU 73.A O no hydrogen 2.917 N/A HIS 41.A NE2 ASP 44.A OD1 no hydrogen 2.866 N/A ASP 44.A N ASP 76.A OD1 no hydrogen 2.667 N/A THR 46.A OG1 ALA 43.A O no hydrogen 2.583 N/A THR 46.A OG1 SER 49.A OG no hydrogen 2.950 N/A SER 49.A OG THR 46.A OG1 no hydrogen 2.950 N/A THR 50.A N THR 46.A O no hydrogen 2.919 N/A THR 50.A OG1 THR 46.A O no hydrogen 2.763 N/A THR 51.A N PRO 47.A O no hydrogen 3.055 N/A THR 51.A OG1 VAL 48.A O no hydrogen 2.487 N/A GLU 52.A N VAL 48.A O no hydrogen 3.034 N/A PHE 53.A N SER 49.A O no hydrogen 2.917 N/A VAL 54.A N THR 50.A O no hydrogen 2.929 N/A SER 55.A N THR 51.A O no hydrogen 2.940 N/A PHE 56.A N GLU 52.A O no hydrogen 2.948 N/A ALA 57.A N PHE 53.A O no hydrogen 2.917 N/A ARG 58.A N VAL 54.A O no hydrogen 2.793 N/A ARG 59.A N SER 55.A O no hydrogen 3.171 N/A ARG 59.A N PHE 56.A O no hydrogen 2.998 N/A ARG 59.A NE ASP 151.A OD1 no hydrogen 2.929 N/A ARG 59.A NH1 SER 55.A O no hydrogen 3.140 N/A ARG 59.A NH2 ASP 151.A OD2 no hydrogen 2.963 N/A TYR 60.A N ALA 57.A O no hydrogen 3.171 N/A PHE 63.A N ARG 59.A O no hydrogen 3.073 N/A GLN 64.A N TYR 60.A O no hydrogen 2.867 N/A GLN 64.A NE2 ASP 69.A OD1 no hydrogen 3.189 N/A ARG 65.A N GLU 61.A O no hydrogen 2.911 N/A ARG 65.A NH1 ASP 62.A OD1 no hydrogen 3.192 N/A ARG 65.A NH1 GLU 224.A OE1 no hydrogen 3.332 N/A ARG 65.A NH2 ASP 62.A OD1 no hydrogen 3.288 N/A LEU 66.A N PHE 63.A O no hydrogen 3.004 N/A GLY 67.A N GLN 64.A O no hydrogen 2.940 N/A VAL 68.A N PHE 63.A O no hydrogen 3.028 N/A ASP 69.A N TRP 35.A O no hydrogen 2.872 N/A ILE 71.A N VAL 37.A O no hydrogen 2.897 N/A GLY 72.A N PRO 99.A O no hydrogen 2.938 N/A SER 74.A N ILE 101.A O no hydrogen 3.238 N/A SER 74.A OG ASP 44.A OD1 no hydrogen 3.343 N/A SER 74.A OG ASP 76.A OD1 no hydrogen 3.010 N/A SER 80.A N SER 77.A OG no hydrogen 3.223 N/A HIS 81.A N SER 77.A O no hydrogen 3.158 N/A HIS 81.A ND1 ASP 44.A OD2 no hydrogen 2.750 N/A HIS 81.A NE2 ILE 101.A O no hydrogen 2.866 N/A ILE 82.A N VAL 78.A O no hydrogen 3.070 N/A LYS 83.A N PHE 79.A O no hydrogen 3.055 N/A LYS 83.A NZ GLU 86.A OE1 no hydrogen 2.930 N/A TRP 84.A N SER 80.A O no hydrogen 2.835 N/A TRP 84.A NE1 THR 50.A OG1 no hydrogen 2.933 N/A LYS 85.A N HIS 81.A O no hydrogen 2.985 N/A LYS 85.A NZ ASP 19.A OD1 no hydrogen 3.431 N/A LYS 85.A NZ ASP 19.A OD2 no hydrogen 2.557 N/A LYS 85.A NZ PHE 98.A O no hydrogen 2.750 N/A GLU 86.A N ILE 82.A O no hydrogen 2.903 N/A TRP 87.A N LYS 83.A O no hydrogen 2.957 N/A ILE 88.A N TRP 84.A O no hydrogen 2.935 N/A GLU 89.A N LYS 85.A O no hydrogen 2.896 N/A ARG 90.A N GLU 86.A O no hydrogen 2.762 N/A HIS 91.A N TRP 87.A O no hydrogen 2.758 N/A ILE 92.A N ILE 88.A O no hydrogen 2.751 N/A GLY 93.A N ILE 88.A O no hydrogen 3.194 N/A ILE 100.A N ASP 19.A OD1 no hydrogen 2.758 N/A ILE 101.A N GLY 72.A O no hydrogen 2.797 N/A ALA 102.A N THR 17.A O no hydrogen 2.866 N/A ASP 103.A N SER 74.A O no hydrogen 3.031 N/A GLY 106.A N ASP 103.A O no hydrogen 2.987 N/A VAL 108.A N ASP 103.A OD1 no hydrogen 2.867 N/A ALA 109.A N ASP 103.A OD2 no hydrogen 2.810 N/A ARG 110.A N GLY 106.A O no hydrogen 2.958 N/A ARG 110.A NH2 GLN 105.A O no hydrogen 2.657 N/A ARG 111.A N THR 107.A O no hydrogen 3.375 N/A ARG 111.A NH1 ARG 111.A O no hydrogen 2.921 N/A LEU 112.A N VAL 108.A O no hydrogen 3.015 N/A LEU 112.A N ALA 109.A O no hydrogen 3.223 N/A GLY 113.A N ARG 110.A O no hydrogen 3.206 N/A LEU 114.A N ALA 109.A O no hydrogen 2.911 N/A HIS 116.A NE2 GLY 113.A O no hydrogen 2.886 N/A THR 121.A N SER 119.A OG no hydrogen 3.028 N/A THR 121.A OG1 SER 119.A OG no hydrogen 3.231 N/A THR 121.A OG1 HIS 122.A ND1 no hydrogen 2.929 N/A HIS 122.A N SER 119.A OG no hydrogen 3.087 N/A THR 123.A OG1 VAL 124.A O no hydrogen 3.342 N/A VAL 124.A N LEU 114.A O no hydrogen 2.979 N/A ARG 125.A N TYR 142.A O no hydrogen 2.891 N/A ARG 125.A NE PRO 143.A O no hydrogen 3.178 N/A ARG 125.A NE MET 144.A O no hydrogen 3.115 N/A ARG 125.A NH1 MET 144.A O no hydrogen 2.528 N/A ARG 125.A NH2 SER 49.A OG no hydrogen 2.836 N/A ARG 125.A NH2 GLU 52.A OE1 no hydrogen 2.865 N/A GLY 126.A N SER 40.A OG no hydrogen 2.918 N/A VAL 127.A N LEU 140.A O no hydrogen 3.003 N/A PHE 128.A N LEU 38.A O no hydrogen 2.683 N/A ILE 129.A N THR 138.A O no hydrogen 3.003 N/A VAL 130.A N PHE 36.A O no hydrogen 2.916 N/A ASP 131.A N VAL 135.A O no hydrogen 2.979 N/A ARG 133.A N ASP 131.A OD1 no hydrogen 2.830 N/A GLY 134.A N ASP 131.A O no hydrogen 2.937 N/A VAL 135.A N ASP 131.A OD1 no hydrogen 2.959 N/A ILE 136.A N GLU 9.A O no hydrogen 2.928 N/A ARG 137.A N ILE 129.A O no hydrogen 2.736 N/A ARG 137.A NH1 ASP 131.A OD2 no hydrogen 2.954 N/A ARG 137.A NH1 ASP 164.A OD2 no hydrogen 2.901 N/A ARG 137.A NH2 ASP 164.A OD1 no hydrogen 2.630 N/A ARG 137.A NH2 ASP 164.A OD2 no hydrogen 3.337 N/A THR 138.A OG1 ARG 137.A O no hydrogen 2.817 N/A LEU 140.A N VAL 127.A O no hydrogen 2.971 N/A TYR 142.A N ARG 125.A O no hydrogen 3.016 N/A GLU 145.A N GLU 145.A OE2 no hydrogen 2.917 N/A LEU 146.A N PRO 143.A O no hydrogen 3.323 N/A ARG 148.A N GLU 52.A OE2 no hydrogen 2.672 N/A ARG 148.A NE GLU 52.A OE2 no hydrogen 2.810 N/A ARG 148.A NH1 SER 40.A O no hydrogen 2.806 N/A ARG 148.A NH2 SER 40.A O no hydrogen 2.742 N/A ARG 148.A NH2 GLU 52.A OE1 no hydrogen 2.753 N/A GLU 152.A N LEU 149.A O no hydrogen 3.168 N/A LEU 154.A N VAL 150.A O no hydrogen 3.148 N/A ARG 155.A N ASP 151.A O no hydrogen 2.929 N/A ARG 155.A NE GLU 152.A OE1 no hydrogen 2.688 N/A ARG 155.A NE GLU 152.A OE2 no hydrogen 3.396 N/A ARG 155.A NH1 TRP 174.A O no hydrogen 2.969 N/A ARG 155.A NH2 GLU 152.A OE2 no hydrogen 2.887 N/A ILE 156.A N GLU 152.A O no hydrogen 2.920 N/A VAL 157.A N ILE 153.A O no hydrogen 3.035 N/A LYS 158.A N LEU 154.A O no hydrogen 3.005 N/A LYS 158.A NZ ASP 221.A OD1 no hydrogen 2.511 N/A LYS 158.A NZ GLU 224.A OE2 no hydrogen 2.526 N/A ALA 159.A N ARG 155.A O no hydrogen 2.768 N/A LEU 160.A N ILE 156.A O no hydrogen 2.897 N/A LYS 161.A N VAL 157.A O no hydrogen 3.033 N/A LYS 161.A NZ LEU 66.A O no hydrogen 2.449 N/A LEU 162.A N LYS 158.A O no hydrogen 3.003 N/A GLY 163.A N ALA 159.A O no hydrogen 2.964 N/A ASP 164.A N LEU 160.A O no hydrogen 2.876 N/A SER 165.A N LYS 161.A O no hydrogen 3.005 N/A LEU 166.A N LEU 162.A O no hydrogen 2.736 N/A ARG 168.A N GLY 163.A O no hydrogen 2.909 N/A ARG 168.A NE ASP 214.A OD1 no hydrogen 2.815 N/A ARG 168.A NE ASP 214.A OD2 no hydrogen 3.434 N/A ARG 168.A NH1 LYS 167.A O no hydrogen 3.016 N/A ARG 168.A NH2 ASP 214.A OD2 no hydrogen 2.837 N/A ALA 169.A N ILE 185.A O no hydrogen 2.745 N/A TRP 174.A N PRO 171.A O no hydrogen 3.173 N/A TRP 174.A NE1 GLU 182.A O no hydrogen 2.839 N/A ASN 176.A N ASP 173.A O no hydrogen 2.850 N/A ASN 177.A N GLY 181.A O no hydrogen 2.821 N/A ASN 177.A ND2 ALA 172.A O no hydrogen 2.778 N/A ILE 179.A N ASN 177.A OD1 no hydrogen 3.006 N/A ILE 180.A N ASN 177.A OD1 no hydrogen 2.854 N/A GLY 181.A N ASN 177.A O no hydrogen 2.690 N/A GLY 183.A N ILE 180.A O no hydrogen 2.834 N/A LEU 184.A N ASP 214.A O no hydrogen 2.737 N/A ILE 185.A N ALA 169.A O no hydrogen 2.822 N/A VAL 186.A N CYS 212.A O no hydrogen 2.952 N/A THR 190.A N GLN 194.A OE1 no hydrogen 2.799 N/A GLN 194.A N THR 191.A OG1 no hydrogen 3.004 N/A ALA 195.A N THR 191.A O no hydrogen 3.094 N/A ARG 196.A N GLU 192.A O no hydrogen 3.012 N/A ARG 196.A NH2 ASP 193.A OD1 no hydrogen 2.575 N/A ALA 197.A N ASP 193.A O no hydrogen 2.988 N/A ARG 198.A N GLN 194.A O no hydrogen 2.960 N/A ARG 198.A NH1 PRO 187.A O no hydrogen 2.835 N/A MET 199.A N ALA 195.A O no hydrogen 3.099 N/A GLU 200.A N ALA 197.A O no hydrogen 2.989 N/A SER 201.A N ALA 197.A O no hydrogen 2.965 N/A SER 201.A OG ARG 198.A O no hydrogen 2.769 N/A GLN 203.A N SER 201.A OG no hydrogen 2.857 N/A ARG 205.A NH1 THR 215.A OG1 no hydrogen 3.130 N/A LEU 207.A N PHE 211.A O no hydrogen 2.782 N/A ASP 208.A N PHE 211.A O no hydrogen 3.524 N/A TRP 209.A N ASP 208.A OD1 no hydrogen 2.692 N/A TRP 210.A NE1 ASP 208.A OD2 no hydrogen 2.917 N/A PHE 211.A N ASP 208.A O no hydrogen 2.753 N/A CYS 212.A SG ASP 208.A O no hydrogen 3.857 N/A TRP 213.A N ARG 205.A O no hydrogen 3.093 N/A ASP 214.A N LEU 184.A O no hydrogen 2.946 N/A ASP 221.A N SER 218.A OG no hydrogen 2.816 N/A VAL 222.A N SER 218.A O no hydrogen 3.029 N/A GLU 223.A N ARG 219.A O no hydrogen 2.784 N/A GLU 224.A N ASP 220.A O no hydrogen 2.871 N/A ALA 225.A N ASP 221.A O no hydrogen 3.135 N/A ARG 226.A N VAL 222.A O no hydrogen 2.838 N/A ARG 226.A NE ASN 176.A OD1 no hydrogen 2.575 N/A ARG 226.A NH2 PRO 175.A O no hydrogen 3.033 N/A ARG 226.A NH2 ASN 176.A OD1 no hydrogen 3.018 N/A ARG 226.A NH2 GLU 182.A OE2 no hydrogen 3.510 N/A ARG 227.A N GLU 223.A O no hydrogen 2.773 N/A TYR 228.A N GLU 224.A O no hydrogen 3.222 N/A LEU 229.A N ALA 225.A O no hydrogen 3.448 N/A ARG 230.A N ARG 226.A O no hydrogen 2.857 N/A ARG 231.A N ARG 227.A O no hydrogen 2.936 N/A ARG 231.A NE ASP 151.A OD1 no hydrogen 2.727 N/A ARG 231.A NH1 ASP 62.A OD2 no hydrogen 2.805 N/A ARG 231.A NH2 ASP 62.A OD2 no hydrogen 2.645 N/A ARG 231.A NH2 ASP 151.A OD1 no hydrogen 2.865 N/A ALA 232.A N TYR 228.A O no hydrogen 3.069 N/A ALA 233.A N LEU 229.A O no hydrogen 3.189 N/A GLU 234.A N ARG 230.A O no hydrogen 2.911 N/A GLU 234.A N ARG 231.A O no hydrogen 3.117 N/A LEU 239.A N GLU 242.A OE1 no hydrogen 2.815 N/A GLU 242.A N LEU 239.A O no hydrogen 3.054 N/A