Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5du0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N SER 1.A OG no hydrogen 3.375 N/A GLU 5.A N LYS 2.A O no hydrogen 3.069 N/A LEU 6.A N GLY 3.A O no hydrogen 2.760 N/A PHE 7.A N GLU 4.A O no hydrogen 2.937 N/A THR 8.A OG1 GLU 5.A O no hydrogen 3.207 N/A VAL 11.A N GLY 34.A O no hydrogen 2.748 N/A ILE 13.A N GLY 32.A O no hydrogen 2.739 N/A LEU 14.A N LEU 115.A O no hydrogen 2.841 N/A VAL 15.A N GLY 30.A O no hydrogen 2.873 N/A GLU 16.A N ASN 117.A O no hydrogen 2.847 N/A LEU 17.A N VAL 28.A O no hydrogen 2.812 N/A ASP 18.A N ILE 119.A O no hydrogen 2.921 N/A GLY 19.A N PHE 26.A O no hydrogen 2.691 N/A ASP 20.A N LEU 121.A O no hydrogen 2.962 N/A VAL 21.A N HIS 24.A O no hydrogen 2.989 N/A ASN 22.A N GLY 123.A O no hydrogen 2.766 N/A ASN 22.A ND2 PHE 126.A O no hydrogen 2.802 N/A GLY 23.A N ASP 20.A OD1 no hydrogen 2.910 N/A HIS 24.A N VAL 21.A O no hydrogen 2.805 N/A PHE 26.A N GLY 19.A O no hydrogen 2.938 N/A SER 27.A N THR 49.A OG1 no hydrogen 3.130 N/A SER 27.A OG ASP 18.A OD1 no hydrogen 2.495 N/A VAL 28.A N LEU 17.A O no hydrogen 2.948 N/A ARG 29.A N ILE 46.A O no hydrogen 2.916 N/A GLY 30.A N VAL 15.A O no hydrogen 2.819 N/A GLU 31.A N LYS 44.A O no hydrogen 2.988 N/A GLY 32.A N ILE 13.A O no hydrogen 3.283 N/A GLU 33.A N THR 42.A O no hydrogen 2.921 N/A GLY 34.A N VAL 11.A O no hydrogen 2.797 N/A ASP 35.A N LYS 40.A O no hydrogen 2.752 N/A THR 37.A N ASP 35.A OD1 no hydrogen 2.894 N/A THR 37.A OG1 THR 8.A O no hydrogen 3.342 N/A ASN 38.A N ASP 35.A O no hydrogen 3.213 N/A LYS 40.A N ASP 35.A O no hydrogen 3.027 N/A LYS 40.A N ASN 38.A OD1 no hydrogen 3.182 N/A LEU 41.A N GLU 218.A O no hydrogen 2.974 N/A THR 42.A N GLU 33.A O no hydrogen 2.958 N/A THR 42.A OG1 GLU 33.A O no hydrogen 3.551 N/A LEU 43.A N LEU 216.A O no hydrogen 3.014 N/A LYS 44.A N GLU 31.A O no hydrogen 2.943 N/A LYS 44.A NZ ASP 206.A OD2 no hydrogen 2.882 N/A LYS 44.A NZ GLU 209.A OE1 no hydrogen 2.979 N/A PHE 45.A N MET 214.A O no hydrogen 2.711 N/A ILE 46.A N ARG 29.A O no hydrogen 2.841 N/A CYS 47.A N ASP 212.A O no hydrogen 2.884 N/A CYS 47.A SG SER 27.A O no hydrogen 3.614 N/A CYS 47.A SG THR 49.A OG1 no hydrogen 3.553 N/A CYS 47.A SG GLY 50.A O no hydrogen 3.361 N/A THR 48.A N SER 27.A O no hydrogen 2.969 N/A THR 48.A OG1 SER 27.A O no hydrogen 3.334 N/A LEU 52.A N ASP 212.A OD2 no hydrogen 2.956 N/A TRP 56.A NE1 ASP 212.A OD1 no hydrogen 3.016 N/A THR 58.A N PRO 55.A O no hydrogen 2.839 N/A THR 58.A OG1 PRO 55.A O no hydrogen 2.555 N/A THR 58.A OG1 TYR 102.A OH no hydrogen 2.906 N/A LEU 59.A N TRP 56.A O no hydrogen 2.944 N/A VAL 60.A N PRO 57.A O no hydrogen 3.338 N/A THR 61.A OG1 HIS 177.A NE2 no hydrogen 2.742 N/A LEU 63.A N LEU 59.A O no hydrogen 2.812 N/A PHE 67.A N VAL 64.A O no hydrogen 2.958 N/A SER 68.A N LEU 65.A O no hydrogen 3.121 N/A SER 68.A OG LEU 65.A O no hydrogen 2.653 N/A ARG 69.A N VAL 220.A O no hydrogen 2.845 N/A TYR 70.A OH HIS 195.A NE2 no hydrogen 2.778 N/A MET 74.A N PRO 71.A O no hydrogen 2.714 N/A LYS 75.A N ASP 72.A O no hydrogen 3.259 N/A LYS 75.A NZ ASP 72.A OD1 no hydrogen 2.411 N/A HIS 77.A N MET 74.A O no hydrogen 2.771 N/A LYS 81.A N ASP 78.A OD1 no hydrogen 3.208 N/A LYS 81.A NZ CYS 66.A O no hydrogen 2.894 N/A LYS 81.A NZ SER 68.A O no hydrogen 2.774 N/A LYS 81.A NZ ASP 78.A OD2 no hydrogen 2.699 N/A SER 82.A OG PHE 79.A O no hydrogen 2.722 N/A MET 84.A N LYS 81.A O no hydrogen 2.996 N/A GLY 87.A N ALA 83.A O no hydrogen 2.739 N/A TYR 88.A N VAL 108.A O no hydrogen 2.882 N/A VAL 89.A N THR 182.A O no hydrogen 2.753 N/A GLN 90.A N ALA 106.A O no hydrogen 2.766 N/A GLU 91.A N GLN 180.A O no hydrogen 2.865 N/A ARG 92.A N THR 104.A O no hydrogen 2.966 N/A ARG 92.A NE GLN 179.A OE1 no hydrogen 2.708 N/A ARG 92.A NH1 THR 61.A O no hydrogen 2.765 N/A ARG 92.A NH2 GLN 179.A OE1 no hydrogen 2.776 N/A THR 93.A N TYR 178.A O no hydrogen 2.930 N/A ILE 94.A N TYR 102.A O no hydrogen 2.810 N/A SER 95.A N ASP 176.A O no hydrogen 2.837 N/A PHE 96.A N GLY 100.A O no hydrogen 2.931 N/A LYS 97.A N LEU 174.A O no hydrogen 3.056 N/A GLY 100.A N ASP 99.A OD1 no hydrogen 2.758 N/A THR 101.A N ILE 124.A O no hydrogen 2.963 N/A TYR 102.A N ILE 94.A O no hydrogen 2.789 N/A TYR 102.A OH THR 58.A OG1 no hydrogen 2.906 N/A LYS 103.A N LYS 122.A O no hydrogen 2.766 N/A THR 104.A N ARG 92.A O no hydrogen 2.922 N/A ARG 105.A N GLU 120.A O no hydrogen 2.964 N/A ARG 105.A NH2 GLU 107.A OE2 no hydrogen 3.210 N/A ALA 106.A N GLN 90.A O no hydrogen 2.859 N/A GLU 107.A N ARG 118.A O no hydrogen 2.927 N/A VAL 108.A N TYR 88.A O no hydrogen 2.856 N/A LYS 109.A N VAL 116.A O no hydrogen 2.980 N/A LYS 109.A NZ GLU 107.A OE1 no hydrogen 3.282 N/A LYS 109.A NZ GLU 111.A OE2 no hydrogen 3.369 N/A PHE 110.A N PRO 85.A O no hydrogen 3.075 N/A GLU 111.A N THR 114.A O no hydrogen 2.864 N/A THR 114.A N GLU 111.A O no hydrogen 3.061 N/A LEU 115.A N PRO 12.A O no hydrogen 2.934 N/A VAL 116.A N LYS 109.A O no hydrogen 2.832 N/A ASN 117.A N LEU 14.A O no hydrogen 2.802 N/A ASN 117.A ND2 THR 62.A O no hydrogen 3.354 N/A ASN 117.A ND2 LEU 63.A O no hydrogen 3.121 N/A ARG 118.A N GLU 107.A O no hydrogen 2.914 N/A ARG 118.A NE GLU 16.A OE1 no hydrogen 3.017 N/A ARG 118.A NH1 GLU 111.A OE2 no hydrogen 2.641 N/A ARG 118.A NH2 GLU 16.A OE1 no hydrogen 3.515 N/A ARG 118.A NH2 GLU 111.A OE1 no hydrogen 3.264 N/A ARG 118.A NH2 GLU 111.A OE2 no hydrogen 3.116 N/A ILE 119.A N GLU 16.A O no hydrogen 2.721 N/A GLU 120.A N ARG 105.A O no hydrogen 2.830 N/A LEU 121.A N ASP 18.A O no hydrogen 2.883 N/A LYS 122.A N LYS 103.A O no hydrogen 2.893 N/A GLY 123.A N ASP 20.A O no hydrogen 2.484 N/A ILE 124.A N THR 101.A O no hydrogen 3.008 N/A PHE 126.A N ASN 22.A OD1 no hydrogen 3.117 N/A LYS 127.A N ASP 99.A OD1 no hydrogen 2.917 N/A GLY 130.A N LYS 127.A O no hydrogen 2.781 N/A ASN 131.A ND2 GLN 173.A OE1 no hydrogen 2.938 N/A GLY 134.A N GLY 130.A O no hydrogen 2.931 N/A HIS 135.A N ILE 132.A O no hydrogen 3.013 N/A HIS 135.A NE2 LEU 52.A O no hydrogen 3.144 N/A LYS 136.A N ASN 131.A O no hydrogen 2.912 N/A LYS 136.A NZ ASP 129.A O no hydrogen 2.399 N/A GLU 138.A N ASN 166.A O no hydrogen 2.899 N/A TYR 139.A OH SER 204.A O no hydrogen 2.552 N/A ASN 140.A ND2 GLU 138.A OE1 no hydrogen 3.162 N/A HIS 144.A N THR 199.A O no hydrogen 3.089 N/A VAL 146.A N LEU 197.A O no hydrogen 2.955 N/A ILE 148.A N HIS 195.A O no hydrogen 2.831 N/A THR 149.A N LYS 158.A O no hydrogen 3.105 N/A THR 149.A OG1 LYS 158.A O no hydrogen 3.504 N/A ASP 151.A N GLY 156.A O no hydrogen 2.859 N/A ASN 155.A N LYS 152.A O no hydrogen 2.987 N/A GLY 156.A N ASP 151.A O no hydrogen 3.014 N/A ILE 157.A N ASN 181.A O no hydrogen 3.078 N/A LYS 158.A N THR 149.A O no hydrogen 2.900 N/A LYS 158.A NZ THR 149.A OG1 no hydrogen 3.091 N/A SER 159.A N GLN 179.A O no hydrogen 2.986 N/A SER 159.A OG TYR 147.A O no hydrogen 2.770 N/A PHE 161.A N HIS 177.A O no hydrogen 3.072 N/A LYS 162.A NZ ASP 176.A OD1 no hydrogen 3.427 N/A ILE 163.A N ALA 175.A O no hydrogen 2.933 N/A HIS 165.A N GLN 173.A O no hydrogen 2.880 N/A VAL 167.A N SER 171.A O no hydrogen 2.936 N/A GLU 168.A N LYS 136.A O no hydrogen 2.814 N/A GLY 170.A N VAL 167.A O no hydrogen 2.944 N/A SER 171.A N ASP 169.A OD1 no hydrogen 2.781 N/A SER 171.A OG ASP 169.A OD1 no hydrogen 2.513 N/A SER 171.A OG ASP 169.A OD2 no hydrogen 3.370 N/A GLN 173.A N HIS 165.A O no hydrogen 2.735 N/A GLN 173.A NE2 LYS 97.A O no hydrogen 3.123 N/A GLN 173.A NE2 LEU 174.A O no hydrogen 3.064 N/A ALA 175.A N ILE 163.A O no hydrogen 2.842 N/A ASP 176.A N SER 95.A O no hydrogen 2.761 N/A HIS 177.A N PHE 161.A O no hydrogen 2.762 N/A HIS 177.A ND1 ALA 175.A O no hydrogen 2.893 N/A HIS 177.A NE2 THR 61.A OG1 no hydrogen 2.742 N/A TYR 178.A N THR 93.A O no hydrogen 2.782 N/A GLN 179.A N SER 159.A O no hydrogen 2.770 N/A GLN 179.A NE2 ASN 181.A OD1 no hydrogen 2.896 N/A GLN 180.A N GLU 91.A O no hydrogen 2.886 N/A ASN 181.A N ILE 157.A O no hydrogen 2.835 N/A ASN 181.A ND2 GLN 90.A OE1 no hydrogen 2.853 N/A THR 182.A N VAL 89.A O no hydrogen 2.957 N/A ILE 184.A N GLY 87.A O no hydrogen 2.959 N/A LEU 190.A N SER 82.A OG no hydrogen 2.913 N/A ASP 193.A N HIS 77.A ND1 no hydrogen 3.073 N/A HIS 195.A N ILE 148.A O no hydrogen 3.230 N/A HIS 195.A ND1 ASP 193.A O no hydrogen 2.958 N/A HIS 195.A NE2 TYR 70.A OH no hydrogen 2.778 N/A TYR 196.A N ALA 223.A O no hydrogen 3.106 N/A LEU 197.A N VAL 146.A O no hydrogen 2.816 N/A SER 198.A N THR 221.A O no hydrogen 2.737 N/A SER 198.A OG GLN 200.A OE1 no hydrogen 3.092 N/A THR 199.A N HIS 144.A O no hydrogen 2.900 N/A THR 199.A OG1 HIS 144.A O no hydrogen 2.713 N/A GLN 200.A N PHE 219.A O no hydrogen 2.923 N/A LYS 202.A N LEU 217.A O no hydrogen 2.680 N/A SER 204.A N VAL 215.A O no hydrogen 2.990 N/A LYS 205.A NZ HIS 213.A O no hydrogen 2.891 N/A ASP 206.A N HIS 213.A NE2 no hydrogen 2.969 N/A ASN 208.A N ASP 206.A OD1 no hydrogen 2.971 N/A GLU 209.A N ASP 206.A O no hydrogen 3.019 N/A ARG 211.A N GLU 209.A OE2 no hydrogen 2.941 N/A ARG 211.A NE GLU 209.A OE2 no hydrogen 2.664 N/A ARG 211.A NH1 GLU 209.A OE1 no hydrogen 2.866 N/A ARG 211.A NH1 GLU 209.A OE2 no hydrogen 3.353 N/A HIS 213.A ND1 ARG 211.A O no hydrogen 2.831 N/A MET 214.A N PHE 45.A O no hydrogen 2.930 N/A VAL 215.A N SER 204.A O no hydrogen 3.130 N/A LEU 216.A N LEU 43.A O no hydrogen 2.789 N/A LEU 217.A N LYS 202.A O no hydrogen 2.871 N/A GLU 218.A N LEU 41.A O no hydrogen 2.967 N/A PHE 219.A N GLN 200.A O no hydrogen 2.824 N/A VAL 220.A N GLY 39.A O no hydrogen 2.937 N/A THR 221.A N SER 198.A O no hydrogen 3.035 N/A ALA 222.A N ARG 69.A O no hydrogen 2.881 N/A ALA 223.A N TYR 196.A O no hydrogen 2.943 N/A HIS 227.A ND1 THR 226.A O no hydrogen 2.311 N/A