Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g78_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N SER 1.A OG.A no hydrogen 2.949 N/A ASP 5.A N ASN 2.A O no hydrogen 2.991 N/A HIS 8.A N ASP 5.A OD1 no hydrogen 2.918 N/A HIS 8.A ND1 ASP 5.A OD1 no hydrogen 2.711 N/A ARG 9.A N ASP 5.A O no hydrogen 2.923 N/A ARG 9.A NE MET 4.A O no hydrogen 2.843 N/A LYS 10.A N HIS 6.A O no hydrogen 2.959 N/A LEU 11.A N LEU 7.A O no hydrogen 2.924 N/A ARG 12.A N HIS 8.A O no hydrogen 3.047 N/A ARG 12.A NH1 ALA 3.A O no hydrogen 2.864 N/A ARG 12.A NH2 ALA 3.A O no hydrogen 3.294 N/A ASP 13.A N ARG 9.A O no hydrogen 2.881 N/A HIS 14.A N LYS 10.A O no hydrogen 2.764 N/A HIS 14.A NE2.A ASN 130.A O no hydrogen 2.824 N/A HIS 14.A NE2.B ASN 130.A OD1 no hydrogen 2.728 N/A GLU 15.A N LEU 11.A O no hydrogen 2.916 N/A ALA 16.A N ARG 12.A O no hydrogen 2.952 N/A ALA 17.A N ASP 13.A O no hydrogen 2.876 N/A MET 18.A N HIS 14.A O no hydrogen 2.960 N/A PHE 19.A N GLU 15.A O no hydrogen 3.100 N/A GLN 20.A N ALA 16.A O no hydrogen 2.876 N/A GLN 21.A N ALA 17.A O no hydrogen 2.922 N/A GLN 21.A NE2 GLN 20.A OE1 no hydrogen 2.830 N/A GLY 22.A N PHE 19.A O no hydrogen 2.967 N/A TYR 23.A N MET 18.A O no hydrogen 2.858 N/A ASP 25.A N GLY 90.A O no hydrogen 2.987 N/A GLN 27.A N ASP 25.A OD1 no hydrogen 2.940 N/A GLN 27.A NE2 SER 88.A O no hydrogen 2.973 N/A PHE 28.A N ASP 25.A O no hydrogen 2.853 N/A GLN 30.A N ASP 26.A O no hydrogen 2.855 N/A GLN 30.A NE2 ASP 26.A OD2 no hydrogen 3.010 N/A LEU 31.A N GLN 27.A O no hydrogen 3.095 N/A GLN 32.A N PHE 28.A O no hydrogen 3.017 N/A GLN 32.A NE2 GLU 15.A OE2.B no hydrogen 2.542 N/A LYS 33.A N GLN 30.A O no hydrogen 3.409 N/A ASP 41.A N.A SER 39.A OG no hydrogen 3.222 N/A ASP 41.A N.B SER 39.A OG no hydrogen 2.873 N/A PHE 42.A N SER 39.A O no hydrogen 3.046 N/A ILE 44.A N PRO 40.A O.A no hydrogen 3.413 N/A ILE 44.A N ASP 41.A O.B no hydrogen 3.172 N/A GLU 45.A N ASP 41.A O.A no hydrogen 2.842 N/A GLU 45.A N ASP 41.A O.B no hydrogen 3.455 N/A VAL 46.A N PHE 42.A O no hydrogen 2.957 N/A MET 47.A N VAL 43.A O no hydrogen 2.864 N/A THR 48.A N.B ILE 44.A O no hydrogen 2.931 N/A THR 48.A N.B GLU 45.A O no hydrogen 3.373 N/A THR 48.A O.B MET 47.A O no hydrogen 3.392 N/A THR 48.A O.B MET 49.A O.B no hydrogen 3.387 N/A THR 48.A OG1.B ILE 44.A O no hydrogen 3.019 N/A MET 49.A N.B VAL 46.A O no hydrogen 3.138 N/A MET 49.A O.B THR 48.A O.B no hydrogen 3.387 N/A MET 49.A SD.B GLU 45.A O no hydrogen 3.918 N/A PHE 50.A N.B MET 47.A O no hydrogen 3.211 N/A PHE 50.A O.B PHE 51.A O.B no hydrogen 3.361 N/A PHE 50.A O.B SER 54.A OG.B no hydrogen 2.811 N/A PHE 51.A N.B MET 47.A O no hydrogen 2.803 N/A PHE 51.A O.B PHE 50.A O.B no hydrogen 3.361 N/A PHE 51.A O.B ASP 52.A O.B no hydrogen 3.279 N/A PHE 51.A O.B TYR 124.A OH no hydrogen 3.323 N/A ASP 52.A N.B MET 49.A O.B no hydrogen 3.407 N/A ASP 52.A N.B ASP 52.A OD1.B no hydrogen 3.159 N/A ASP 52.A O.B PHE 51.A O.B no hydrogen 3.279 N/A ASP 52.A OD1.B ASP 52.A OD2.B no hydrogen 2.225 N/A ASP 52.A OD2.B ASP 52.A OD1.B no hydrogen 2.225 N/A ASP 53.A N.B MET 49.A O.B no hydrogen 3.102 N/A ASP 53.A OD1.B ASP 53.A OD2.B no hydrogen 2.176 N/A ASP 53.A OD2.B ASP 53.A OD1.B no hydrogen 2.176 N/A SER 54.A N.B PHE 51.A O.B no hydrogen 3.297 N/A SER 54.A N.B SER 54.A OG.B no hydrogen 2.955 N/A SER 54.A O.B GLU 55.A O.B no hydrogen 3.424 N/A SER 54.A OG.B PHE 50.A O.B no hydrogen 2.811 N/A GLU 55.A N.B PHE 51.A O.B no hydrogen 2.900 N/A GLU 55.A O.B SER 54.A O.B no hydrogen 3.424 N/A GLU 55.A O.B LYS 56.A O.B no hydrogen 3.397 N/A GLU 55.A OE1.B GLU 55.A OE2.B no hydrogen 2.190 N/A GLU 55.A OE2.B GLU 55.A OE1.B no hydrogen 2.190 N/A GLU 55.A OE2.B TYR 124.A OH no hydrogen 2.655 N/A LYS 56.A O.B GLU 55.A O.B no hydrogen 3.397 N/A LYS 56.A O.B LEU 57.A O.B no hydrogen 3.404 N/A LEU 57.A N.B SER 54.A O.B no hydrogen 3.218 N/A LEU 57.A O.B LYS 56.A O.B no hydrogen 3.404 N/A LEU 58.A N SER 54.A O.B no hydrogen 2.823 N/A ASN 59.A N GLU 55.A O.B no hydrogen 3.032 N/A ASN 60.A N LYS 56.A O.B no hydrogen 2.903 N/A MET 61.A N LEU 57.A O.B no hydrogen 2.864 N/A SER 62.A N LEU 58.A O no hydrogen 2.932 N/A SER 62.A OG.B LEU 58.A O no hydrogen 2.933 N/A SER 62.A OG.B GLN 121.A OE1.A no hydrogen 3.154 N/A ARG 63.A N ASN 59.A O no hydrogen 3.015 N/A ARG 63.A NE.A GLU 66.A OE1 no hydrogen 2.556 N/A ARG 63.A NH1.A GLU 66.A OE1 no hydrogen 3.375 N/A ARG 63.A NH1.A GLU 66.A OE2 no hydrogen 2.993 N/A ARG 63.A NH1.B ASN 60.A OD1 no hydrogen 2.522 N/A ALA 64.A N ASN 60.A O no hydrogen 2.919 N/A LEU 65.A N MET 61.A O no hydrogen 3.020 N/A GLU 66.A N ARG 63.A O no hydrogen 3.083 N/A GLN 67.A N ALA 64.A O no hydrogen 3.268 N/A GLN 67.A NE2 ARG 63.A O no hydrogen 2.889 N/A GLN 74.A N ASN 71.A OD1 no hydrogen 3.025 N/A ILE 75.A N ASN 71.A O no hydrogen 3.103 N/A ASP 76.A N PHE 72.A O no hydrogen 2.922 N/A ALA 77.A N LYS 73.A O no hydrogen 2.967 N/A HIS 78.A N GLN 74.A O no hydrogen 2.933 N/A ALA 79.A N ILE 75.A O no hydrogen 2.931 N/A HIS 80.A N ASP 76.A O no hydrogen 2.946 N/A GLN 81.A N ALA 77.A O no hydrogen 2.960 N/A GLN 82.A N HIS 78.A O no hydrogen 2.894 N/A GLN 82.A NE2 SER 54.A OG.B no hydrogen 2.890 N/A GLN 82.A NE2 SER 86.A OG no hydrogen 3.249 N/A LYS 83.A N ALA 79.A O no hydrogen 2.867 N/A GLY 84.A N HIS 80.A O no hydrogen 3.147 N/A SER 85.A N GLN 81.A O no hydrogen 3.019 N/A SER 86.A N GLN 82.A O no hydrogen 2.862 N/A SER 86.A OG GLN 82.A O no hydrogen 2.752 N/A ALA 87.A N LYS 83.A O no hydrogen 2.905 N/A SER 88.A N GLY 84.A O no hydrogen 3.031 N/A SER 88.A N SER 85.A O no hydrogen 3.122 N/A SER 88.A OG SER 85.A O no hydrogen 2.676 N/A VAL 89.A N SER 86.A O no hydrogen 3.242 N/A GLY 90.A N ALA 87.A O no hydrogen 3.393 N/A ALA 91.A N SER 86.A O no hydrogen 3.033 N/A ALA 92.A N TYR 23.A O no hydrogen 3.238 N/A ARG 93.A NE GLU 123.A OE1 no hydrogen 2.838 N/A ARG 93.A NH1 GLN 21.A O no hydrogen 2.938 N/A ARG 93.A NH2 GLU 123.A OE1 no hydrogen 3.354 N/A ARG 93.A NH2 GLU 123.A OE2 no hydrogen 3.015 N/A LYS 95.A N ALA 91.A O no hydrogen 2.896 N/A LYS 95.A NZ ASN 96.A OD1 no hydrogen 2.871 N/A ASN 96.A N ALA 92.A O no hydrogen 2.963 N/A VAL 97.A N ARG 93.A O no hydrogen 3.100 N/A CYS 98.A N VAL 94.A O no hydrogen 3.079 N/A CYS 98.A SG VAL 94.A O no hydrogen 3.385 N/A GLY 99.A N LYS 95.A O no hydrogen 3.307 N/A GLY 99.A N ASN 96.A O no hydrogen 3.121 N/A THR 100.A N VAL 97.A O no hydrogen 2.973 N/A THR 100.A OG1 VAL 97.A O no hydrogen 2.658 N/A PHE 101.A N CYS 98.A O no hydrogen 3.453 N/A CYS 105.A N PHE 101.A O no hydrogen 2.914 N/A CYS 105.A SG PHE 72.A O no hydrogen 3.455 N/A CYS 105.A SG PHE 101.A O no hydrogen 3.530 N/A GLU 106.A N ARG 102.A O no hydrogen 2.863 N/A ALA 107.A N ASN 103.A O no hydrogen 3.340 N/A GLN 108.A N CYS 105.A O no hydrogen 3.016 N/A ASN 109.A N PHE 104.A O no hydrogen 2.921 N/A GLY 112.A N ASN 109.A OD1 no hydrogen 2.792 N/A CYS 113.A N.A ASN 109.A O no hydrogen 3.190 N/A CYS 113.A N.B ASN 109.A O no hydrogen 3.197 N/A CYS 113.A SG.A ASN 109.A O no hydrogen 3.399 N/A CYS 113.A SG.B ASN 109.A O no hydrogen 3.217 N/A VAL 114.A N LEU 110.A O no hydrogen 2.824 N/A ARG 115.A N GLU 111.A O no hydrogen 3.022 N/A CYS 116.A N GLY 112.A O no hydrogen 2.936 N/A CYS 116.A SG THR 100.A O no hydrogen 3.702 N/A CYS 116.A SG THR 100.A OG1 no hydrogen 3.255 N/A CYS 116.A SG GLY 112.A O no hydrogen 3.252 N/A LEU 117.A N CYS 113.A O.A no hydrogen 2.858 N/A LEU 117.A N CYS 113.A O.B no hydrogen 2.855 N/A GLN 118.A N VAL 114.A O no hydrogen 2.920 N/A GLN 119.A N ARG 115.A O no hydrogen 3.031 N/A LEU 120.A N CYS 116.A O no hydrogen 2.876 N/A GLN 121.A N LEU 117.A O no hydrogen 2.836 N/A GLN 122.A N GLN 118.A O no hydrogen 3.027 N/A GLU 123.A N GLN 119.A O no hydrogen 2.886 N/A TYR 124.A N LEU 120.A O no hydrogen 2.854 N/A TYR 124.A OH GLU 55.A OE2.B no hydrogen 2.655 N/A SER 125.A N GLN 121.A O no hydrogen 3.000 N/A SER 125.A OG.B GLN 121.A O no hydrogen 3.131 N/A LEU 126.A N GLN 122.A O no hydrogen 2.984 N/A LEU 127.A N GLU 123.A O no hydrogen 2.938 N/A LYS 128.A N TYR 124.A O no hydrogen 2.854 N/A LYS 128.A NZ GLU 55.A OE2.B no hydrogen 2.602 N/A ASN 129.A N SER 125.A O no hydrogen 2.906 N/A ASN 130.A N LEU 126.A O no hydrogen 3.039 N/A ASN 130.A ND2 LEU 126.A O no hydrogen 2.887 N/A LEU 131.A N LEU 127.A O no hydrogen 2.848 N/A LYS 132.A N LYS 128.A O no hydrogen 2.856 N/A TYR 133.A N ASN 129.A O no hydrogen 3.161 N/A LEU 134.A N ASN 130.A O no hydrogen 3.099 N/A PHE 135.A N LEU 131.A O no hydrogen 2.899 N/A LYS 136.A N LYS 132.A O no hydrogen 2.892 N/A LYS 136.A NZ GLU 140.A OE2 no hydrogen 2.749 N/A LEU 137.A N TYR 133.A O no hydrogen 3.041 N/A GLN 138.A N LEU 134.A O no hydrogen 3.014 N/A GLN 138.A NE2.B PRO 40.A O.B no hydrogen 3.003 N/A GLN 139.A N.A PHE 135.A O no hydrogen 2.922 N/A GLN 139.A N.B PHE 135.A O no hydrogen 2.903 N/A GLN 139.A NE2.A ASP 41.A OD1.A no hydrogen 3.274 N/A GLN 139.A NE2.A ASP 41.A OD1.B no hydrogen 3.107 N/A GLN 139.A NE2.B ASP 41.A OD1.A no hydrogen 3.343 N/A GLN 139.A NE2.B ASP 41.A OD1.B no hydrogen 3.023 N/A GLU 140.A N LYS 136.A O no hydrogen 2.979 N/A ILE 141.A N LEU 137.A O no hydrogen 2.995 N/A LYS 142.A N GLN 138.A O no hydrogen 2.975 N/A LYS 142.A NZ ASP 41.A OD1.A no hydrogen 3.341 N/A LYS 142.A NZ ASP 41.A OD2.A no hydrogen 2.923 N/A LYS 142.A NZ ASP 41.A OD2.B no hydrogen 2.636 N/A THR 143.A N GLN 139.A O.A no hydrogen 2.953 N/A THR 143.A N GLN 139.A O.B no hydrogen 2.914 N/A THR 143.A OG1 GLN 139.A O.A no hydrogen 2.972 N/A THR 143.A OG1 GLN 139.A O.B no hydrogen 2.994 N/A ALA 144.A N GLU 140.A O no hydrogen 3.019 N/A GLY 145.A N ILE 141.A O no hydrogen 3.091 N/A GLY 145.A N LYS 142.A O no hydrogen 3.087 N/A ARG 146.A N THR 143.A O no hydrogen 3.283 N/A