Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qgi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 13.A N ASP 11.A OD1 no hydrogen 2.949 N/A SER 13.A OG ASP 11.A OD1 no hydrogen 2.644 N/A SER 13.A OG ASP 11.A OD2 no hydrogen 3.474 N/A MET 16.A N LYS 45.A O no hydrogen 2.960 N/A PHE 17.A N LYS 45.A O no hydrogen 3.056 N/A SER 18.A N TYR 76.A O no hydrogen 2.899 N/A SER 18.A OG GLU 47.A OE2 no hydrogen 2.648 N/A VAL 19.A N GLU 47.A O no hydrogen 2.791 N/A CYS 20.A N ILE 78.A O no hydrogen 2.734 N/A SER 21.A N LEU 49.A O no hydrogen 2.907 N/A LEU 22.A N CYS 80.A O no hydrogen 3.314 N/A VAL 23.A N ALA 51.A O no hydrogen 3.053 N/A ARG 24.A N GLU 82.A OE1 no hydrogen 2.744 N/A ASP 25.A N GLU 82.A OE1 no hydrogen 2.770 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 2.959 N/A LYS 28.A N ASP 25.A OD1 no hydrogen 3.033 N/A TYR 29.A N ASP 25.A O no hydrogen 3.045 N/A ASP 30.A N GLN 26.A O no hydrogen 2.811 N/A ARG 31.A N ALA 27.A O no hydrogen 3.145 N/A LEU 32.A N LYS 28.A O no hydrogen 2.966 N/A LEU 33.A N TYR 29.A O no hydrogen 2.884 N/A GLU 34.A N ASP 30.A O no hydrogen 2.945 N/A SER 35.A N ARG 31.A O no hydrogen 3.009 N/A SER 35.A OG ARG 31.A O no hydrogen 3.485 N/A SER 35.A OG LEU 32.A O no hydrogen 2.791 N/A PHE 36.A N LEU 32.A O no hydrogen 2.930 N/A GLU 37.A N LEU 33.A O no hydrogen 3.031 N/A ARG 38.A N GLU 34.A O no hydrogen 2.952 N/A PHE 39.A N SER 35.A O no hydrogen 3.032 N/A GLY 40.A N GLU 37.A O no hydrogen 3.174 N/A PHE 41.A N PHE 36.A O no hydrogen 2.923 N/A THR 42.A OG1 ASP 44.A OD1 no hydrogen 2.651 N/A LYS 45.A N THR 42.A O no hydrogen 2.778 N/A ALA 46.A N THR 42.A O no hydrogen 2.898 N/A GLU 47.A N PHE 17.A O no hydrogen 3.044 N/A LEU 49.A N VAL 19.A O no hydrogen 2.856 N/A ALA 51.A N SER 21.A O no hydrogen 2.865 N/A ASN 53.A N VAL 23.A O no hydrogen 2.759 N/A ASN 53.A ND2 PHE 59.A O no hydrogen 2.918 N/A ARG 54.A N ASP 52.A OD1 no hydrogen 3.022 N/A ARG 54.A NE ASP 52.A OD1 no hydrogen 2.942 N/A ARG 54.A NH1 GLN 26.A OE1 no hydrogen 2.811 N/A ARG 54.A NH2 ASP 52.A OD2 no hydrogen 2.899 N/A GLN 58.A N GLY 56.A O no hydrogen 2.979 N/A GLN 58.A NE2 ASP 52.A O no hydrogen 2.835 N/A PHE 59.A N ASN 53.A OD1 no hydrogen 2.898 N/A HIS 60.A N SER 63.A OG no hydrogen 3.129 N/A GLY 61.A N GLY 173.A O no hydrogen 2.800 N/A PHE 62.A N HIS 60.A ND1 no hydrogen 3.196 N/A SER 63.A N HIS 60.A O no hydrogen 3.206 N/A SER 63.A OG HIS 60.A O no hydrogen 3.487 N/A TRP 64.A N HIS 60.A O no hydrogen 3.114 N/A LYS 66.A N SER 63.A O no hydrogen 3.213 N/A LYS 66.A NZ PHE 62.A O no hydrogen 2.723 N/A LYS 66.A NZ ASN 167.A O no hydrogen 2.771 N/A GLN 67.A N TRP 64.A O no hydrogen 3.294 N/A MET 68.A N TRP 64.A O no hydrogen 3.255 N/A LEU 69.A N HIS 65.A O no hydrogen 2.836 N/A ARG 71.A N MET 68.A O no hydrogen 2.953 N/A CYS 72.A N LEU 69.A O no hydrogen 3.042 N/A CYS 72.A SG MET 68.A O no hydrogen 3.401 N/A LYS 73.A N GLU 47.A OE2 no hydrogen 2.816 N/A GLY 74.A N SER 18.A OG no hydrogen 2.877 N/A ARG 75.A N LEU 15.A O no hydrogen 2.938 N/A ARG 75.A NE ASP 11.A OD2 no hydrogen 2.813 N/A ARG 75.A NH2 ASP 11.A OD2 no hydrogen 3.480 N/A TYR 76.A N MET 16.A O no hydrogen 2.926 N/A VAL 77.A N MET 159.A O no hydrogen 2.740 N/A ILE 78.A N SER 18.A O no hydrogen 2.854 N/A PHE 79.A N LEU 157.A O no hydrogen 2.828 N/A CYS 80.A N CYS 20.A O no hydrogen 2.857 N/A CYS 80.A SG CYS 20.A O no hydrogen 3.928 N/A CYS 80.A SG SER 21.A OG no hydrogen 3.351 N/A CYS 80.A SG HIS 81.A O no hydrogen 3.624 N/A HIS 81.A N CYS 155.A O no hydrogen 2.861 N/A HIS 81.A NE2 TYR 177.A OH no hydrogen 2.918 N/A GLU 85.A N HIS 200.A O no hydrogen 2.823 N/A LEU 86.A N SER 35.A OG no hydrogen 2.992 N/A ARG 89.A N ASP 88.A OD1 no hydrogen 2.757 N/A ARG 89.A NE ASP 93.A OD2 no hydrogen 3.000 N/A GLY 90.A N ASP 93.A OD2 no hydrogen 3.073 N/A TYR 91.A N PHE 39.A O no hydrogen 2.830 N/A LEU 94.A N GLY 90.A O no hydrogen 2.920 N/A VAL 95.A N TYR 91.A O no hydrogen 2.958 N/A ALA 96.A N ASP 92.A O no hydrogen 2.905 N/A ALA 97.A N ASP 93.A O no hydrogen 2.947 N/A ILE 98.A N LEU 94.A O no hydrogen 2.942 N/A GLU 99.A N VAL 95.A O no hydrogen 2.877 N/A ALA 100.A N ALA 96.A O no hydrogen 2.890 N/A LEU 101.A N ALA 97.A O no hydrogen 2.974 N/A GLU 102.A N ILE 98.A O no hydrogen 2.938 N/A GLU 103.A N GLU 99.A O no hydrogen 3.115 N/A ALA 104.A N ALA 100.A O no hydrogen 2.891 N/A ASP 105.A N LEU 101.A O no hydrogen 2.780 N/A LYS 107.A N ASP 105.A OD1 no hydrogen 3.048 N/A TRP 108.A N ASP 105.A O no hydrogen 3.067 N/A TRP 108.A NE1 GLU 102.A OE1 no hydrogen 2.869 N/A LEU 109.A N ARG 191.A O no hydrogen 2.738 N/A VAL 110.A N ARG 191.A O no hydrogen 3.270 N/A ALA 111.A N LEU 158.A O no hydrogen 2.938 N/A GLY 112.A N TYR 193.A O no hydrogen 2.852 N/A GLY 115.A N ALA 129.A O no hydrogen 2.923 N/A SER 116.A N SER 151.A O no hydrogen 3.091 N/A SER 116.A OG ALA 127.A O no hydrogen 2.733 N/A TRP 118.A N ARG 148.A O no hydrogen 2.969 N/A TRP 118.A NE1 GLU 186.A OE1 no hydrogen 2.871 N/A ARG 119.A N GLU 150.A OE1 no hydrogen 2.755 N/A HIS 123.A ND1 HIS 232.A NE2 no hydrogen 2.825 N/A SER 124.A N ASN 122.A OD1 no hydrogen 2.910 N/A SER 124.A OG ASN 122.A OD1 no hydrogen 2.631 N/A ALA 127.A N HIS 232.A ND1 no hydrogen 2.936 N/A ALA 129.A N GLY 115.A O no hydrogen 2.816 N/A LEU 130.A N ARG 142.A O no hydrogen 2.907 N/A HIS 131.A N VAL 113.A O no hydrogen 3.429 N/A HIS 131.A ND1 ASP 196.A OD1 no hydrogen 2.670 N/A HIS 131.A NE2 ASP 139.A OD1 no hydrogen 2.599 N/A ILE 132.A N ARG 140.A O no hydrogen 2.999 N/A SER 133.A N LEU 199.A O no hydrogen 2.961 N/A SER 133.A OG HIS 198.A NE2 no hydrogen 2.705 N/A ASP 134.A N GLY 137.A O no hydrogen 2.965 N/A PHE 136.A N ASP 134.A OD1 no hydrogen 2.827 N/A GLY 137.A N ASP 134.A O no hydrogen 2.954 N/A ASP 139.A N SER 133.A OG no hydrogen 2.795 N/A ARG 140.A N ILE 132.A O no hydrogen 2.888 N/A ARG 140.A NE ASP 134.A OD1 no hydrogen 2.792 N/A ARG 140.A NE ASP 134.A OD2 no hydrogen 3.409 N/A ARG 140.A NH2 ASP 134.A OD2 no hydrogen 2.779 N/A ARG 141.A NH1 ASP 196.A OD2 no hydrogen 3.153 N/A ARG 141.A NH2 ASP 196.A OD2 no hydrogen 3.068 N/A ARG 142.A N LEU 130.A O no hydrogen 3.060 N/A CYS 147.A N ALA 194.A O no hydrogen 2.892 N/A CYS 147.A SG ASN 144.A O no hydrogen 3.438 N/A CYS 147.A SG ARG 148.A O no hydrogen 3.968 N/A VAL 149.A N ALA 192.A O no hydrogen 2.833 N/A GLU 150.A N SER 116.A O no hydrogen 2.831 N/A SER 151.A OG HIS 232.A O no hydrogen 2.648 N/A ASP 153.A N ALA 114.A O no hydrogen 2.761 N/A CYS 155.A N ASP 153.A OD2 no hydrogen 2.815 N/A CYS 155.A SG ASP 153.A OD2 no hydrogen 3.364 N/A LEU 157.A N PHE 79.A O no hydrogen 2.979 N/A LEU 158.A N ALA 111.A O no hydrogen 2.815 N/A MET 159.A N VAL 77.A O no hydrogen 2.990 N/A ARG 160.A NH1 TRP 108.A O no hydrogen 2.819 N/A ARG 160.A NH2 GLU 102.A OE1 no hydrogen 2.773 N/A ARG 160.A NH2 TRP 108.A O no hydrogen 2.996 N/A ARG 161.A N ARG 75.A O no hydrogen 2.903 N/A ARG 161.A NE GLY 74.A O no hydrogen 2.919 N/A LYS 163.A N ARG 160.A O no hydrogen 2.992 N/A ASN 167.A ND2 TYR 177.A O no hydrogen 2.928 N/A ASN 167.A ND2 ASP 180.A OD2 no hydrogen 2.862 N/A SER 168.A N ASP 180.A OD2 no hydrogen 2.763 N/A SER 168.A OG ASP 180.A OD1 no hydrogen 2.723 N/A SER 168.A OG ASP 180.A OD2 no hydrogen 3.402 N/A GLY 173.A N HIS 60.A ND1 no hydrogen 3.389 N/A GLY 178.A N GLU 154.A OE2 no hydrogen 2.826 N/A ASP 180.A N TYR 176.A O no hydrogen 2.858 N/A LEU 181.A N TYR 177.A O no hydrogen 3.226 N/A CYS 182.A N GLY 178.A O no hydrogen 3.086 N/A CYS 182.A SG GLY 178.A O no hydrogen 3.466 N/A LEU 183.A N ALA 179.A O no hydrogen 2.928 N/A GLN 184.A N ASP 180.A O no hydrogen 2.959 N/A GLN 184.A NE2 TYR 222.A OH no hydrogen 2.956 N/A ALA 185.A N LEU 181.A O no hydrogen 2.939 N/A GLU 186.A N CYS 182.A O no hydrogen 3.135 N/A PHE 187.A N LEU 183.A O no hydrogen 3.015 N/A LEU 188.A N GLN 184.A O no hydrogen 2.911 N/A GLY 189.A N GLU 186.A O no hydrogen 2.938 N/A GLY 190.A N ALA 185.A O no hydrogen 2.853 N/A ARG 191.A N LYS 107.A O no hydrogen 3.005 N/A ARG 191.A NH1 ASP 105.A OD2 no hydrogen 2.870 N/A TYR 193.A N VAL 110.A O no hydrogen 2.979 N/A TYR 193.A OH ASP 105.A OD2 no hydrogen 2.506 N/A ALA 194.A N CYS 147.A O no hydrogen 2.883 N/A ILE 195.A N GLY 112.A O no hydrogen 2.795 N/A HIS 198.A ND1 ASP 88.A OD1 no hydrogen 2.695 N/A HIS 198.A NE2 SER 133.A OG no hydrogen 2.705 N/A HIS 200.A N GLU 85.A O no hydrogen 2.932 N/A HIS 201.A N SER 133.A O no hydrogen 2.844 N/A TYR 202.A N ASP 83.A O no hydrogen 2.944 N/A TYR 202.A OH GLU 85.A OE1 no hydrogen 2.358 N/A PHE 211.A N ASP 208.A OD1 no hydrogen 2.956 N/A HIS 212.A N ASP 208.A O no hydrogen 3.078 N/A ARG 213.A N GLU 209.A O no hydrogen 2.774 N/A ARG 213.A NH1 GLN 172.A O no hydrogen 3.532 N/A ARG 213.A NH1 GLU 217.A OE2 no hydrogen 3.022 N/A ARG 213.A NH2 GLN 172.A O no hydrogen 2.996 N/A LEU 214.A N ASN 210.A O no hydrogen 2.841 N/A ARG 215.A N PHE 211.A O no hydrogen 2.875 N/A GLN 216.A N HIS 212.A O no hydrogen 3.073 N/A GLU 217.A N ARG 213.A O no hydrogen 2.855 N/A MET 218.A N LEU 214.A O no hydrogen 2.772 N/A ALA 219.A N ARG 215.A O no hydrogen 3.081 N/A GLN 220.A N GLN 216.A O no hydrogen 2.839 N/A LYS 221.A N GLU 217.A O no hydrogen 2.892 N/A LYS 221.A NZ SER 168.A OG no hydrogen 3.156 N/A LYS 221.A NZ ASP 170.A OD1 no hydrogen 2.855 N/A TYR 222.A N MET 218.A O no hydrogen 2.871 N/A TYR 222.A OH ASP 180.A OD1 no hydrogen 2.563 N/A ARG 223.A N ALA 219.A O no hydrogen 2.962 N/A ARG 224.A N LYS 221.A O no hydrogen 3.367 N/A TRP 225.A N TYR 222.A O no hydrogen 3.112 N/A PHE 226.A N TYR 222.A O no hydrogen 2.801 N/A GLY 228.A N GLY 241.A O no hydrogen 2.856 N/A ARG 229.A N PHE 226.A O no hydrogen 3.097 N/A ARG 229.A NH2 GLU 150.A OE1 no hydrogen 2.826 N/A LEU 231.A N VAL 238.A O no hydrogen 2.848 N/A HIS 232.A N GLU 150.A OE2 no hydrogen 2.694 N/A HIS 232.A NE2 HIS 123.A ND1 no hydrogen 2.825 N/A CYS 233.A N GLY 236.A O no hydrogen 3.130 N/A GLY 236.A N CYS 233.A O no hydrogen 2.868 N/A ARG 237.A NE THR 126.A OG1 no hydrogen 2.878 N/A ARG 237.A NH1 HIS 123.A O no hydrogen 2.793 N/A VAL 238.A N LEU 231.A O no hydrogen 2.757 N/A LEU 240.A N ARG 229.A O no hydrogen 2.912 N/A GLY 242.A N GLU 246.A OE2 no hydrogen 2.819 N/A TYR 245.A N GLY 242.A O no hydrogen 3.235 N/A GLU 246.A N GLY 243.A O no hydrogen 3.269 N/A ALA 247.A N TRP 244.A O no hydrogen 3.258 N/A