Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ill_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG GLU 25.A OE1 no hydrogen 2.916 N/A THR 3.A N GLY 26.A O no hydrogen 2.876 N/A PHE 5.A N GLY 24.A O no hydrogen 2.896 N/A LYS 6.A N TYR 105.A O no hydrogen 2.857 N/A PHE 7.A N GLY 22.A O no hydrogen 2.845 N/A GLN 8.A N.A ASN 107.A O no hydrogen 2.923 N/A GLN 8.A N.B ASN 107.A O no hydrogen 2.930 N/A LEU 9.A N VAL 20.A O no hydrogen 2.863 N/A LYS 10.A N VAL 109.A O no hydrogen 2.971 N/A GLY 11.A N PHE 18.A O no hydrogen 2.959 N/A THR 12.A N PHE 111.A O no hydrogen 2.918 N/A ILE 13.A N LYS 16.A O no hydrogen 2.893 N/A ASN 14.A N GLY 113.A O no hydrogen 2.803 N/A ASN 14.A ND2 PHE 116.A O no hydrogen 2.862 N/A LYS 16.A N ILE 13.A O no hydrogen 2.904 N/A PHE 18.A N GLY 11.A O no hydrogen 2.867 N/A THR 19.A N SER 41.A OG no hydrogen 3.127 N/A THR 19.A OG1 THR 40.A OG1 no hydrogen 2.825 N/A VAL 20.A N LEU 9.A O no hydrogen 2.938 N/A GLU 21.A N VAL 38.A O no hydrogen 2.915 N/A GLY 22.A N PHE 7.A O no hydrogen 2.863 N/A GLU 23.A N.A LYS 36.A O no hydrogen 2.913 N/A GLU 23.A N.B LYS 36.A O no hydrogen 2.916 N/A GLY 24.A N PHE 5.A O no hydrogen 3.016 N/A GLU 25.A N LYS 34.A O no hydrogen 2.969 N/A GLY 26.A N THR 3.A O no hydrogen 2.929 N/A ASN 27.A N SER 32.A O no hydrogen 2.836 N/A HIS 29.A N ASN 27.A OD1 no hydrogen 2.900 N/A GLU 30.A N ASN 27.A OD1 no hydrogen 3.227 N/A GLY 31.A N ASN 27.A O no hydrogen 2.751 N/A SER 32.A N ASN 27.A O no hydrogen 2.952 N/A HIS 33.A N GLU 207.A O no hydrogen 2.951 N/A LYS 34.A N GLU 25.A O no hydrogen 2.888 N/A GLY 35.A N GLN 205.A O no hydrogen 2.995 N/A LYS 36.A N GLU 23.A O.A no hydrogen 2.914 N/A LYS 36.A N GLU 23.A O.B no hydrogen 2.937 N/A LYS 36.A NZ ASP 195.A OD2 no hydrogen 2.925 N/A LYS 36.A NZ GLU 198.A OE1 no hydrogen 2.811 N/A TYR 37.A N ILE 203.A O no hydrogen 2.863 N/A VAL 38.A N GLU 21.A O no hydrogen 2.814 N/A CYS 39.A N ASP 201.A O no hydrogen 2.923 N/A CYS 39.A SG THR 19.A O no hydrogen 3.655 N/A CYS 39.A SG SER 41.A OG no hydrogen 3.251 N/A CYS 39.A SG GLY 42.A O no hydrogen 3.170 N/A THR 40.A N THR 19.A O no hydrogen 3.121 N/A THR 40.A OG1 THR 19.A OG1 no hydrogen 2.825 N/A GLY 42.A N CYS 39.A O no hydrogen 3.449 N/A LEU 44.A N ASP 201.A OD2 no hydrogen 2.759 N/A SER 47.A N VAL 122.A O no hydrogen 2.728 N/A TRP 48.A NE1 ASP 201.A OD1 no hydrogen 3.238 N/A ALA 50.A N SER 47.A OG no hydrogen 3.106 N/A LEU 51.A N TRP 48.A O no hydrogen 3.075 N/A GLY 52.A N ALA 49.A O no hydrogen 2.963 N/A THR 53.A OG1 GLN 166.A OE1 no hydrogen 2.934 N/A PHE 55.A N LEU 51.A O no hydrogen 2.988 N/A LYS 57.A NZ HIS 137.A NE2 no hydrogen 2.978 N/A TYR 58.A OH HIS 98.A ND1 no hydrogen 2.987 N/A TYR 59.A N MET 56.A O no hydrogen 3.161 N/A TYR 59.A OH THR 3.A O no hydrogen 2.740 N/A THR 60.A N LYS 57.A O no hydrogen 3.014 N/A THR 60.A OG1 LYS 57.A O no hydrogen 2.779 N/A LYS 61.A N LEU 209.A O no hydrogen 3.071 N/A TYR 62.A OH HIS 184.A NE2 no hydrogen 2.777 N/A LEU 66.A N PRO 63.A O no hydrogen 3.179 N/A LYS 67.A NZ GLU 72.A OE1 no hydrogen 3.065 N/A LYS 67.A NZ ASP 180.A O no hydrogen 3.326 N/A TRP 69.A NE1 PRO 179.A O no hydrogen 2.820 N/A HIS 71.A N ASN 68.A O no hydrogen 3.050 N/A HIS 71.A N ASN 68.A OD1 no hydrogen 3.176 N/A GLU 72.A N ASN 68.A O no hydrogen 2.848 N/A VAL 73.A N TRP 69.A O no hydrogen 3.120 N/A MET 74.A N HIS 71.A O no hydrogen 3.130 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.697 N/A GLY 77.A N VAL 73.A O no hydrogen 2.868 N/A PHE 78.A N HIS 98.A O no hydrogen 2.909 N/A THR 79.A N LYS 171.A O no hydrogen 2.760 N/A THR 79.A OG1 LYS 171.A O no hydrogen 3.420 N/A TYR 80.A N HIS 96.A O no hydrogen 2.925 N/A ASP 81.A N ILE 169.A O no hydrogen 2.877 N/A ARG 82.A N ALA 94.A O no hydrogen 2.905 N/A ARG 82.A NE THR 168.A OG1 no hydrogen 2.712 N/A ARG 82.A NH1 THR 53.A O no hydrogen 2.835 N/A ARG 82.A NH2 THR 168.A OG1 no hydrogen 3.228 N/A HIS 83.A N ASN 167.A O no hydrogen 2.922 N/A ILE 84.A N ILE 92.A O no hydrogen 2.884 N/A GLN 85.A N HIS 165.A O no hydrogen 2.877 N/A GLN 85.A NE2 TYR 86.A O no hydrogen 3.019 N/A GLN 85.A NE2 ASP 89.A O no hydrogen 3.298 N/A TYR 86.A N GLY 90.A O no hydrogen 2.993 N/A LYS 87.A N GLU 163.A O no hydrogen 2.750 N/A ASP 89.A N TYR 86.A O no hydrogen 3.043 N/A GLY 90.A N ASP 89.A OD1 no hydrogen 2.748 N/A SER 91.A N GLN 114.A O no hydrogen 2.912 N/A ILE 92.A N ILE 84.A O no hydrogen 2.829 N/A HIS 93.A N THR 112.A O no hydrogen 2.836 N/A HIS 93.A NE2 ASP 81.A OD1 no hydrogen 2.497 N/A ALA 94.A N ARG 82.A O no hydrogen 2.919 N/A LYS 95.A N GLU 110.A O no hydrogen 2.930 N/A HIS 96.A N TYR 80.A O no hydrogen 2.934 N/A HIS 96.A ND1 ASN 107.A OD1 no hydrogen 3.028 N/A GLN 97.A N ILE 108.A O no hydrogen 2.865 N/A HIS 98.A N PHE 78.A O no hydrogen 2.849 N/A HIS 98.A ND1 TYR 58.A OH no hydrogen 2.987 N/A PHE 99.A N HIS 106.A O no hydrogen 3.066 N/A MET 100.A N PRO 75.A O no hydrogen 3.268 N/A LYS 101.A N THR 104.A O no hydrogen 2.944 N/A THR 104.A N LYS 101.A O no hydrogen 2.936 N/A TYR 105.A N PRO 4.A O no hydrogen 2.935 N/A HIS 106.A N PHE 99.A O no hydrogen 2.789 N/A ASN 107.A N LYS 6.A O no hydrogen 2.979 N/A ASN 107.A ND2 SER 54.A O no hydrogen 3.159 N/A ASN 107.A ND2 PHE 55.A O no hydrogen 3.447 N/A ILE 108.A N GLN 97.A O no hydrogen 2.937 N/A VAL 109.A N GLN 8.A O.A no hydrogen 2.860 N/A VAL 109.A N GLN 8.A O.B no hydrogen 2.826 N/A GLU 110.A N LYS 95.A O no hydrogen 2.882 N/A PHE 111.A N LYS 10.A O no hydrogen 2.914 N/A THR 112.A N HIS 93.A O no hydrogen 2.939 N/A GLY 113.A N THR 12.A O no hydrogen 2.843 N/A GLN 114.A N SER 91.A O no hydrogen 2.904 N/A PHE 116.A N ASN 14.A OD1 no hydrogen 3.173 N/A LYS 117.A N ASP 89.A OD1 no hydrogen 2.948 N/A SER 120.A N LYS 117.A O no hydrogen 2.937 N/A SER 120.A OG ASP 89.A OD2 no hydrogen 2.545 N/A VAL 122.A N SER 120.A OG no hydrogen 3.107 N/A LEU 123.A N SER 120.A O no hydrogen 2.888 N/A THR 124.A N SER 120.A O no hydrogen 3.004 N/A THR 124.A OG1 SER 120.A O no hydrogen 3.285 N/A GLY 125.A N PRO 121.A O no hydrogen 3.042 N/A ASN 128.A N PRO 153.A O no hydrogen 2.745 N/A VAL 129.A N ASN 128.A OD1 no hydrogen 2.800 N/A SER 130.A N TYR 190.A OH no hydrogen 3.392 N/A SER 130.A OG TYR 190.A OH no hydrogen 2.709 N/A LEU 131.A N LEU 151.A O no hydrogen 2.950 N/A ASN 133.A N LYS 188.A O no hydrogen 2.975 N/A VAL 135.A N ILE 186.A O no hydrogen 2.883 N/A GLN 136.A NE2 TYR 183.A OH no hydrogen 2.745 N/A HIS 137.A N HIS 184.A O no hydrogen 2.928 N/A HIS 137.A ND1 VAL 135.A O no hydrogen 2.996 N/A ILE 138.A N GLU 145.A O no hydrogen 2.859 N/A ARG 140.A N.A GLY 143.A O no hydrogen 2.876 N/A ARG 140.A N.B GLY 143.A O no hydrogen 2.872 N/A ARG 140.A NE.A GLU 145.A OE1 no hydrogen 2.758 N/A ARG 140.A NE.B ASP 142.A OD1 no hydrogen 3.496 N/A ARG 140.A NH1.B GLU 145.A OE1 no hydrogen 2.906 N/A ARG 140.A NH2.A GLU 145.A OE1 no hydrogen 2.844 N/A GLY 143.A N ARG 140.A O.A no hydrogen 2.931 N/A GLY 143.A N ARG 140.A O.B no hydrogen 2.936 N/A VAL 144.A N CYS 170.A O no hydrogen 3.013 N/A GLU 145.A N ILE 138.A O no hydrogen 2.880 N/A CYS 146.A N THR 168.A O no hydrogen 2.859 N/A CYS 146.A SG GLN 136.A O no hydrogen 3.667 N/A VAL 148.A N GLN 166.A O no hydrogen 2.906 N/A LEU 150.A N ALA 164.A O no hydrogen 2.823 N/A TYR 152.A N VAL 162.A O no hydrogen 2.905 N/A LEU 154.A N LYS 160.A O no hydrogen 2.910 N/A SER 156.A N ASP 126.A OD1 no hydrogen 2.755 N/A SER 156.A OG ASP 126.A OD1 no hydrogen 3.441 N/A SER 156.A OG ASP 126.A OD2 no hydrogen 2.604 N/A SER 159.A N ASP 157.A OD1 no hydrogen 3.155 N/A SER 159.A OG ASP 157.A OD1 no hydrogen 2.720 N/A SER 159.A OG ASP 157.A OD2 no hydrogen 3.523 N/A LYS 160.A N ASP 157.A O no hydrogen 3.080 N/A VAL 162.A N TYR 152.A O no hydrogen 2.875 N/A ALA 164.A N LEU 150.A O no hydrogen 2.946 N/A HIS 165.A N GLN 85.A O no hydrogen 2.874 N/A GLN 166.A N VAL 148.A O no hydrogen 2.874 N/A ASN 167.A N HIS 83.A O no hydrogen 2.896 N/A ASN 167.A ND2 GLU 145.A OE2 no hydrogen 3.088 N/A THR 168.A N CYS 146.A O no hydrogen 2.948 N/A ILE 169.A N ASP 81.A O no hydrogen 2.899 N/A CYS 170.A N VAL 144.A O no hydrogen 2.815 N/A LYS 171.A N THR 79.A O no hydrogen 3.061 N/A LEU 173.A N GLY 77.A O no hydrogen 3.030 N/A GLN 176.A N HIS 174.A O no hydrogen 2.758 N/A GLN 176.A NE2 ASN 175.A O no hydrogen 2.720 N/A HIS 184.A ND1 PRO 182.A O no hydrogen 2.594 N/A HIS 184.A NE2 TYR 62.A OH no hydrogen 2.777 N/A TRP 185.A N HIS 212.A O no hydrogen 2.978 N/A ILE 186.A N VAL 135.A O no hydrogen 2.934 N/A ARG 187.A N GLU 210.A O no hydrogen 2.828 N/A ARG 187.A NH1 GLU 134.A OE2 no hydrogen 2.869 N/A LYS 188.A N ASN 133.A O no hydrogen 2.890 N/A GLN 189.A N THR 208.A O no hydrogen 3.008 N/A TYR 190.A OH SER 130.A OG no hydrogen 2.709 N/A THR 191.A N SER 206.A O no hydrogen 2.863 N/A GLN 192.A NE2 TRP 48.A O no hydrogen 3.081 N/A GLN 192.A NE2 GLN 205.A OE1 no hydrogen 2.803 N/A SER 193.A N CYS 204.A O no hydrogen 2.894 N/A LYS 194.A NZ HIS 202.A O no hydrogen 2.531 N/A ASP 195.A N HIS 202.A NE2 no hydrogen 2.843 N/A THR 197.A N ASP 195.A OD1 no hydrogen 3.096 N/A THR 197.A OG1 ASP 195.A OD1 no hydrogen 2.754 N/A THR 197.A OG1 ASP 195.A OD2 no hydrogen 3.242 N/A GLU 198.A N ASP 195.A O no hydrogen 2.879 N/A ARG 200.A N GLU 198.A OE2 no hydrogen 2.967 N/A ARG 200.A NE GLU 198.A OE2 no hydrogen 2.614 N/A ARG 200.A NH2 GLU 198.A OE1 no hydrogen 2.857 N/A ARG 200.A NH2 GLU 198.A OE2 no hydrogen 3.250 N/A HIS 202.A ND1 ARG 200.A O no hydrogen 2.831 N/A ILE 203.A N TYR 37.A O no hydrogen 2.896 N/A CYS 204.A N SER 193.A O no hydrogen 2.866 N/A GLN 205.A N GLY 35.A O no hydrogen 2.913 N/A GLN 205.A NE2 GLY 52.A O no hydrogen 3.011 N/A GLN 205.A NE2 GLU 207.A OE1 no hydrogen 2.969 N/A SER 206.A N THR 191.A O no hydrogen 2.955 N/A GLU 207.A N HIS 33.A O no hydrogen 2.861 N/A THR 208.A N GLN 189.A O no hydrogen 2.853 N/A THR 208.A OG1 GLN 189.A O no hydrogen 3.515 N/A LEU 209.A N GLY 31.A O no hydrogen 2.786 N/A GLU 210.A N ARG 187.A O no hydrogen 2.964 N/A ALA 211.A N LYS 61.A O no hydrogen 2.871 N/A HIS 212.A N TRP 185.A O no hydrogen 2.872 N/A HIS 212.A ND1 LEU 213.A O no hydrogen 2.868 N/A HIS 212.A NE2 GLU 134.A OE1 no hydrogen 2.593 N/A