Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7e44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ALA 43.A O no hydrogen 3.211 N/A ARG 3.A NH1 ILE 4.A O no hydrogen 3.348 N/A ARG 3.A NH1 ASP 9.A OD1 no hydrogen 3.544 N/A ARG 3.A NH1 ASP 9.A OD2 no hydrogen 2.933 N/A ARG 3.A NH2 ASP 9.A OD1 no hydrogen 2.808 N/A ILE 5.A N GLN 41.A O no hydrogen 2.826 N/A GLU 6.A N ASP 9.A OD2 no hydrogen 2.753 N/A HIS 10.A ND1 GLU 52.A OE1 no hydrogen 2.796 N/A GLY 11.A N GLY 31.A O no hydrogen 2.922 N/A TRP 12.A N PRO 53.A O no hydrogen 2.895 N/A TRP 13.A N PRO 29.A O no hydrogen 2.992 N/A TRP 13.A NE1 GLY 31.A O no hydrogen 2.915 N/A VAL 14.A N TRP 55.A O no hydrogen 2.821 N/A SER 16.A N VAL 57.A O no hydrogen 2.883 N/A SER 16.A OG LYS 20.A O no hydrogen 2.782 N/A HIS 17.A N LYS 20.A O no hydrogen 2.854 N/A GLN 19.A NE2 PRO 195.A O no hydrogen 3.220 N/A GLN 19.A NE2 PRO 197.A O no hydrogen 3.457 N/A LYS 20.A N HIS 17.A O no hydrogen 3.082 N/A LEU 21.A N GLY 66.A O no hydrogen 2.962 N/A TRP 22.A N VAL 15.A O no hydrogen 2.747 N/A LEU 23.A N ASP 64.A O no hydrogen 2.907 N/A GLY 26.A N LEU 23.A O no hydrogen 2.887 N/A GLU 27.A N PRO 24.A O no hydrogen 3.060 N/A GLY 31.A N GLY 11.A O no hydrogen 2.886 N/A ALA 33.A N ASP 9.A O no hydrogen 2.989 N/A ASN 35.A N GLU 32.A O no hydrogen 2.804 N/A PHE 36.A N ALA 33.A O no hydrogen 2.905 N/A LEU 38.A N ALA 33.A O no hydrogen 3.095 N/A GLY 40.A N ILE 5.A O no hydrogen 2.744 N/A GLN 41.A N LEU 38.A O no hydrogen 3.142 N/A ARG 42.A NE ASP 2.A OD1 no hydrogen 3.072 N/A ARG 42.A NH2 ASP 2.A OD2 no hydrogen 2.733 N/A ALA 43.A N ARG 3.A O no hydrogen 3.126 N/A LEU 44.A N LEU 56.A O no hydrogen 2.987 N/A GLN 45.A N MET 1.A O no hydrogen 2.740 N/A GLN 45.A NE2 GLY 47.A O no hydrogen 3.467 N/A ILE 46.A N VAL 54.A O no hydrogen 2.803 N/A TRP 49.A N GLU 52.A O no hydrogen 2.712 N/A GLU 52.A N TRP 49.A O no hydrogen 2.935 N/A VAL 54.A N GLY 47.A O no hydrogen 2.817 N/A TRP 55.A N TRP 12.A O no hydrogen 2.827 N/A LEU 56.A N LEU 44.A O no hydrogen 2.732 N/A VAL 57.A N VAL 14.A O no hydrogen 2.883 N/A GLN 59.A N SER 16.A O no hydrogen 3.201 N/A ARG 61.A NE GLN 59.A OE1 no hydrogen 2.864 N/A ARG 61.A NH2 PHE 36.A O no hydrogen 2.779 N/A ARG 61.A NH2 GLN 59.A OE1 no hydrogen 3.502 N/A GLY 66.A N LEU 21.A O no hydrogen 3.090 N/A ARG 69.A N SER 67.A OG no hydrogen 3.172 N/A GLN 70.A N SER 67.A O no hydrogen 3.166 N/A GLN 70.A NE2 SER 67.A O no hydrogen 3.327 N/A VAL 71.A N VAL 68.A O no hydrogen 2.967 N/A ILE 72.A N ARG 69.A O no hydrogen 3.048 N/A LEU 74.A N VAL 71.A O no hydrogen 3.031 N/A GLY 77.A N ASP 75.A OD1 no hydrogen 2.974 N/A PHE 79.A N ASP 75.A O no hydrogen 2.832 N/A GLN 80.A N VAL 76.A O no hydrogen 2.853 N/A LEU 81.A N GLY 77.A O no hydrogen 3.216 N/A ALA 82.A N LEU 78.A O no hydrogen 2.865 N/A GLY 83.A N PHE 79.A O no hydrogen 2.861 N/A ARG 84.A N GLN 80.A O no hydrogen 2.883 N/A ARG 84.A NH1 ILE 46.A O no hydrogen 2.858 N/A GLY 85.A N LEU 81.A O no hydrogen 3.082 N/A VAL 86.A N ALA 82.A O no hydrogen 3.222 N/A GLN 87.A N GLY 83.A O no hydrogen 2.899 N/A LEU 88.A N ARG 84.A O no hydrogen 2.802 N/A ALA 89.A N GLY 85.A O no hydrogen 2.919 N/A GLU 90.A N VAL 86.A O no hydrogen 3.107 N/A PHE 91.A N GLN 87.A O no hydrogen 2.897 N/A TYR 92.A N LEU 88.A O no hydrogen 2.889 N/A ARG 93.A N ALA 89.A O no hydrogen 3.021 N/A ARG 93.A NE GLU 90.A OE2 no hydrogen 3.019 N/A ARG 93.A NH2 GLU 90.A OE1 no hydrogen 2.897 N/A ARG 93.A NH2 GLU 90.A OE2 no hydrogen 3.567 N/A SER 94.A N GLU 90.A O no hydrogen 2.999 N/A SER 94.A OG PHE 91.A O no hydrogen 2.891 N/A HIS 95.A N TYR 92.A O no hydrogen 3.175 N/A LYS 96.A NZ TYR 97.A OH no hydrogen 2.981 N/A CYS 98.A N HIS 103.A O no hydrogen 2.660 N/A CYS 101.A SG HIS 103.A ND1 no hydrogen 3.388 N/A GLY 102.A N CYS 98.A O no hydrogen 2.736 N/A MET 105.A N LYS 96.A O no hydrogen 3.010 N/A TYR 106.A N LEU 115.A O no hydrogen 2.806 N/A SER 108.A N ALA 113.A O no hydrogen 2.861 N/A SER 108.A OG GLU 111.A O no hydrogen 3.464 N/A THR 110.A N SER 108.A OG no hydrogen 3.173 N/A GLU 111.A N SER 108.A OG no hydrogen 3.249 N/A MET 114.A N TYR 123.A O no hydrogen 2.894 N/A LEU 115.A N TYR 106.A O no hydrogen 2.795 N/A CYS 116.A N GLU 121.A O no hydrogen 3.339 N/A SER 117.A OG GLU 104.A O no hydrogen 2.971 N/A ARG 122.A NH1 TYR 124.A OH no hydrogen 3.491 N/A TYR 123.A N MET 114.A O no hydrogen 3.016 N/A ALA 128.A N GLN 198.A O no hydrogen 2.737 N/A CYS 130.A N LEU 200.A O no hydrogen 2.847 N/A CYS 130.A SG ALA 128.A O no hydrogen 3.475 N/A ILE 131.A N GLY 159.A O no hydrogen 2.910 N/A ILE 132.A N THR 202.A O no hydrogen 2.926 N/A VAL 133.A N LEU 157.A O no hydrogen 2.895 N/A ALA 134.A N PHE 204.A O no hydrogen 3.181 N/A ARG 136.A N ALA 206.A O no hydrogen 2.876 N/A ARG 136.A NE ASP 138.A O no hydrogen 2.824 N/A ARG 136.A NH2 ASP 138.A O no hydrogen 3.457 N/A ARG 136.A NH2 GLU 255.A OE1 no hydrogen 2.871 N/A ARG 136.A NH2 TYR 256.A OH no hydrogen 3.236 N/A ARG 137.A N SER 140.A O no hydrogen 2.790 N/A ARG 137.A NE SER 140.A OG no hydrogen 3.294 N/A SER 140.A N ARG 137.A O no hydrogen 2.889 N/A SER 140.A OG ARG 137.A O no hydrogen 2.703 N/A ILE 141.A N TYR 226.A O no hydrogen 2.835 N/A LEU 142.A N ILE 135.A O no hydrogen 2.859 N/A LEU 143.A N ASN 224.A O no hydrogen 2.967 N/A ALA 144.A N THR 155.A O no hydrogen 2.626 N/A GLN 145.A N GLU 222.A O no hydrogen 3.032 N/A THR 147.A N GLU 219.A O no hydrogen 3.001 N/A THR 147.A OG1 LYS 218.A O no hydrogen 2.562 N/A VAL 153.A N ASN 151.A OD1 no hydrogen 3.324 N/A HIS 154.A N LEU 233.A O no hydrogen 2.678 N/A HIS 154.A NE2 GLU 222.A OE2 no hydrogen 3.044 N/A THR 155.A N ALA 144.A O no hydrogen 2.782 N/A GLY 159.A N ILE 131.A O no hydrogen 3.005 N/A VAL 161.A N PRO 129.A O no hydrogen 2.964 N/A GLU 162.A N GLU 165.A OE1 no hydrogen 2.863 N/A THR 166.A N GLN 169.A OE1 no hydrogen 2.973 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.609 N/A GLN 169.A N THR 166.A OG1 no hydrogen 3.014 N/A ALA 170.A N THR 166.A O no hydrogen 3.063 N/A VAL 171.A N LEU 167.A O no hydrogen 3.029 N/A ALA 172.A N GLU 168.A O no hydrogen 3.162 N/A ARG 173.A N GLN 169.A O no hydrogen 2.923 N/A ARG 173.A NE GLU 165.A OE1 no hydrogen 3.451 N/A ARG 173.A NE GLU 165.A OE2 no hydrogen 2.615 N/A ARG 173.A NH1 GLU 174.A OE2 no hydrogen 2.939 N/A ARG 173.A NH1 GLU 177.A OE1 no hydrogen 3.211 N/A ARG 173.A NH2 PHE 160.A O no hydrogen 3.024 N/A ARG 173.A NH2 GLU 165.A OE1 no hydrogen 3.056 N/A ARG 173.A NH2 GLU 174.A OE2 no hydrogen 3.564 N/A GLU 174.A N ALA 170.A O no hydrogen 2.814 N/A VAL 175.A N VAL 171.A O no hydrogen 2.928 N/A MET 176.A N ALA 172.A O no hydrogen 3.031 N/A GLU 177.A N ARG 173.A O no hydrogen 2.828 N/A GLN 178.A N GLU 174.A O no hydrogen 2.917 N/A GLN 178.A NE2 ALA 158.A O no hydrogen 2.832 N/A GLN 178.A NE2 GLU 174.A OE1 no hydrogen 2.904 N/A SER 179.A N VAL 175.A O no hydrogen 2.797 N/A SER 179.A OG VAL 175.A O no hydrogen 2.741 N/A GLY 180.A N MET 176.A O no hydrogen 2.807 N/A LYS 182.A N SER 210.A O no hydrogen 2.789 N/A LYS 184.A N GLU 207.A O no hydrogen 2.875 N/A ASN 185.A ND2 GLU 207.A OE1 no hydrogen 3.122 N/A ARG 187.A N MET 205.A O no hydrogen 2.814 N/A VAL 189.A N ALA 203.A O no hydrogen 2.648 N/A GLN 192.A N MET 201.A O no hydrogen 2.854 N/A GLN 192.A NE2 GLY 238.A O no hydrogen 2.751 N/A TRP 194.A N SER 199.A O no hydrogen 2.654 N/A PHE 196.A N TRP 194.A O no hydrogen 2.885 N/A SER 199.A N TRP 194.A O no hydrogen 2.833 N/A LEU 200.A N ALA 128.A O no hydrogen 2.816 N/A MET 201.A N GLN 192.A O no hydrogen 2.832 N/A THR 202.A N CYS 130.A O no hydrogen 2.741 N/A THR 202.A OG1 CYS 130.A O no hydrogen 2.770 N/A ALA 203.A N THR 190.A O no hydrogen 2.672 N/A PHE 204.A N ILE 132.A O no hydrogen 3.007 N/A MET 205.A N ARG 187.A O no hydrogen 2.803 N/A ALA 206.A N ALA 134.A O no hydrogen 3.085 N/A GLU 207.A N LYS 184.A O no hydrogen 2.917 N/A TYR 208.A N ARG 136.A O no hydrogen 2.910 N/A TYR 208.A OH GLY 211.A O no hydrogen 2.571 N/A ASP 209.A N LYS 182.A O no hydrogen 3.064 N/A SER 210.A N LYS 182.A O no hydrogen 3.306 N/A VAL 214.A N SER 179.A O no hydrogen 2.779 N/A LYS 218.A N ASP 216.A OD1 no hydrogen 2.826 N/A GLU 219.A N ASP 216.A O no hydrogen 2.759 N/A LEU 220.A N ASP 216.A O no hydrogen 2.881 N/A LEU 221.A N GLN 145.A O no hydrogen 2.843 N/A ASN 224.A N LEU 143.A O no hydrogen 3.054 N/A ASN 224.A ND2 TYR 226.A OH no hydrogen 3.250 N/A TYR 226.A N ILE 141.A O no hydrogen 2.937 N/A ARG 227.A NE ASP 229.A OD1 no hydrogen 2.905 N/A ARG 227.A NH2 ASP 229.A OD1 no hydrogen 3.500 N/A ARG 227.A NH2 ASP 229.A OD2 no hydrogen 3.164 N/A TYR 228.A N ASP 139.A O no hydrogen 3.055 N/A ASP 230.A N ARG 227.A O no hydrogen 2.910 N/A THR 239.A OG1 PRO 236.A O no hydrogen 3.187 N/A VAL 240.A N GLN 192.A OE1 no hydrogen 2.994 N/A ARG 242.A N THR 239.A OG1 no hydrogen 3.114 N/A ARG 242.A NE GLU 246.A OE2 no hydrogen 2.737 N/A ARG 242.A NH1 PRO 235.A O no hydrogen 3.453 N/A ARG 242.A NH2 GLU 246.A OE2 no hydrogen 3.529 N/A ARG 243.A N THR 239.A O no hydrogen 3.258 N/A LEU 244.A N VAL 240.A O no hydrogen 2.915 N/A ILE 245.A N ALA 241.A O no hydrogen 3.049 N/A GLU 246.A N ARG 242.A O no hydrogen 2.801 N/A ASP 247.A N ARG 243.A O no hydrogen 2.799 N/A THR 248.A N LEU 244.A O no hydrogen 2.918 N/A THR 248.A OG1 LEU 244.A O no hydrogen 2.738 N/A VAL 249.A N ILE 245.A O no hydrogen 2.909 N/A ALA 250.A N GLU 246.A O no hydrogen 2.870 N/A MET 251.A N ASP 247.A O no hydrogen 2.981 N/A CYS 252.A N THR 248.A O no hydrogen 3.000 N/A CYS 252.A SG ASP 138.A O no hydrogen 3.673 N/A CYS 252.A SG THR 248.A O no hydrogen 3.558 N/A ARG 253.A N VAL 249.A O no hydrogen 2.845 N/A ALA 254.A N ALA 250.A O no hydrogen 2.935 N/A GLU 255.A N MET 251.A O no hydrogen 3.012 N/A TYR 256.A N CYS 252.A O no hydrogen 2.769 N/A