Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2nnu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG THR 4.A OG1 no hydrogen 3.265 N/A THR 4.A N SER 1.A OG no hydrogen 3.121 N/A THR 4.A OG1 SER 1.A OG no hydrogen 3.265 N/A LEU 5.A N SER 1.A O no hydrogen 3.086 N/A CYS 6.A N MET 2.A O no hydrogen 2.869 N/A CYS 6.A SG MET 2.A O no hydrogen 3.342 N/A CYS 6.A SG ASN 56.A OD1 no hydrogen 3.667 N/A GLN 7.A N GLU 3.A O no hydrogen 3.164 N/A ARG 8.A N THR 4.A O no hydrogen 3.036 N/A LEU 9.A N LEU 5.A O no hydrogen 2.868 N/A ASN 10.A N CYS 6.A O no hydrogen 2.998 N/A VAL 11.A N GLN 7.A O no hydrogen 3.319 N/A CYS 12.A N ARG 8.A O no hydrogen 2.975 N/A CYS 12.A SG HIS 36.A O no hydrogen 3.243 N/A GLN 13.A N LEU 9.A O no hydrogen 2.806 N/A GLN 13.A NE2 GLU 40.A OE2 no hydrogen 2.898 N/A GLN 13.A NE2 GLN 58.A OE1 no hydrogen 3.170 N/A ASP 14.A N ASN 10.A O no hydrogen 2.923 N/A LYS 15.A N VAL 11.A O no hydrogen 2.929 N/A LYS 15.A NZ ASP 32.A OD1 no hydrogen 2.655 N/A LYS 15.A NZ ASP 32.A OD2 no hydrogen 3.409 N/A ILE 16.A N CYS 12.A O no hydrogen 3.069 N/A LEU 17.A N GLN 13.A O no hydrogen 2.889 N/A THR 18.A N ASP 14.A O no hydrogen 2.992 N/A THR 18.A OG1 ASP 14.A O no hydrogen 3.029 N/A HIS 19.A N LYS 15.A O no hydrogen 3.039 N/A HIS 19.A NE2 ASP 32.A OD1 no hydrogen 2.698 N/A TYR 20.A N ILE 16.A O no hydrogen 3.019 N/A TYR 20.A OH TYR 33.A OH no hydrogen 2.509 N/A GLU 21.A N LEU 17.A O no hydrogen 2.936 N/A ASN 22.A N THR 18.A O no hydrogen 2.896 N/A ASP 23.A N HIS 19.A O no hydrogen 3.141 N/A SER 24.A OG ASP 29.A OD1 no hydrogen 2.687 N/A ASP 26.A N SER 24.A OG no hydrogen 2.976 N/A ARG 28.A N ASP 26.A OD1 no hydrogen 2.960 N/A ASP 29.A N ASP 26.A O no hydrogen 3.034 N/A HIS 30.A N LEU 27.A O no hydrogen 2.944 N/A HIS 30.A NE2 TRP 93.A O no hydrogen 2.773 N/A ILE 31.A N LEU 27.A O no hydrogen 3.124 N/A ASP 32.A N ARG 28.A O no hydrogen 3.227 N/A TYR 33.A N ASP 29.A O no hydrogen 2.988 N/A TYR 33.A OH TYR 20.A OH no hydrogen 2.509 N/A TRP 34.A N HIS 30.A O no hydrogen 3.024 N/A TRP 34.A NE1 VAL 98.A O no hydrogen 2.961 N/A LYS 35.A N ILE 31.A O no hydrogen 2.884 N/A HIS 36.A N ASP 32.A O no hydrogen 3.074 N/A HIS 36.A ND1 ASP 32.A O no hydrogen 2.836 N/A MET 37.A N TYR 33.A O no hydrogen 2.901 N/A ARG 38.A N TRP 34.A O no hydrogen 2.878 N/A ARG 38.A NH1 GLN 77.A OE1 no hydrogen 2.914 N/A LEU 39.A N LYS 35.A O no hydrogen 3.061 N/A GLU 40.A N HIS 36.A O no hydrogen 2.905 N/A CYS 41.A N MET 37.A O no hydrogen 3.122 N/A CYS 41.A SG MET 37.A O no hydrogen 3.382 N/A ALA 42.A N ARG 38.A O no hydrogen 3.246 N/A ILE 43.A N LEU 39.A O no hydrogen 2.914 N/A TYR 44.A N GLU 40.A O no hydrogen 2.961 N/A TYR 45.A N CYS 41.A O no hydrogen 2.931 N/A LYS 46.A N ALA 42.A O no hydrogen 2.897 N/A ALA 47.A N ILE 43.A O no hydrogen 2.893 N/A ARG 48.A N TYR 44.A O no hydrogen 3.055 N/A ARG 48.A NH1 VAL 60.A O no hydrogen 2.748 N/A GLU 49.A N TYR 45.A O no hydrogen 2.923 N/A MET 50.A N LYS 46.A O no hydrogen 2.997 N/A MET 50.A N ALA 47.A O no hydrogen 3.198 N/A GLY 51.A N ARG 48.A O no hydrogen 2.946 N/A PHE 52.A N ALA 47.A O no hydrogen 2.999 N/A ILE 55.A N GLN 58.A O no hydrogen 2.897 N/A ASN 56.A ND2 ASN 10.A OD1 no hydrogen 3.223 N/A HIS 57.A N HIS 54.A ND1 no hydrogen 2.880 N/A GLN 58.A N ILE 55.A O no hydrogen 2.937 N/A GLN 58.A NE2 GLN 13.A OE1 no hydrogen 2.895 N/A VAL 60.A N LYS 53.A O no hydrogen 3.018 N/A VAL 65.A N THR 62.A O no hydrogen 3.084 N/A SER 66.A N THR 62.A O no hydrogen 3.143 N/A LYS 67.A N LEU 63.A O no hydrogen 2.890 N/A ASN 68.A N ALA 64.A O no hydrogen 3.086 N/A LYS 69.A N VAL 65.A O no hydrogen 3.036 N/A ALA 70.A N SER 66.A O no hydrogen 2.862 N/A LEU 71.A N LYS 67.A O no hydrogen 2.907 N/A GLN 72.A N ASN 68.A O no hydrogen 3.028 N/A ALA 73.A N LYS 69.A O no hydrogen 2.918 N/A ILE 74.A N ALA 70.A O no hydrogen 2.833 N/A GLU 75.A N LEU 71.A O no hydrogen 3.033 N/A LEU 76.A N GLN 72.A O no hydrogen 2.923 N/A GLN 77.A N ALA 73.A O no hydrogen 2.817 N/A GLN 77.A NE2 GLU 81.A OE2 no hydrogen 2.860 N/A LEU 78.A N ILE 74.A O no hydrogen 2.999 N/A THR 79.A N GLU 75.A O no hydrogen 2.968 N/A THR 79.A OG1 GLU 75.A O no hydrogen 2.815 N/A LEU 80.A N LEU 76.A O no hydrogen 2.919 N/A GLU 81.A N GLN 77.A O no hydrogen 2.953 N/A THR 82.A N LEU 78.A O no hydrogen 3.034 N/A THR 82.A OG1 LEU 78.A O no hydrogen 3.119 N/A ILE 83.A N THR 79.A O no hydrogen 2.972 N/A TYR 84.A N LEU 80.A O no hydrogen 2.818 N/A ASN 85.A N GLU 81.A O no hydrogen 3.137 N/A ASN 85.A N THR 82.A O no hydrogen 3.193 N/A SER 86.A N ILE 83.A O no hydrogen 2.939 N/A SER 86.A OG ILE 83.A O no hydrogen 2.602 N/A TYR 88.A N SER 86.A OG no hydrogen 3.031 N/A SER 89.A N SER 86.A O no hydrogen 3.284 N/A SER 89.A OG SER 86.A O no hydrogen 3.309 N/A GLU 91.A N TYR 88.A O no hydrogen 3.207 N/A TRP 93.A N THR 25.A O no hydrogen 3.097 N/A TRP 93.A NE1 TYR 88.A O no hydrogen 3.039 N/A THR 94.A N ASP 97.A OD2 no hydrogen 2.923 N/A ASP 97.A N THR 94.A OG1 no hydrogen 3.022 N/A VAL 98.A N THR 94.A O no hydrogen 3.186 N/A VAL 98.A N LEU 95.A O no hydrogen 3.231 N/A SER 99.A N GLN 96.A O no hydrogen 3.089 N/A SER 99.A OG GLN 96.A O no hydrogen 2.780 N/A SER 99.A OG GLN 96.A OE1 no hydrogen 3.511 N/A VAL 102.A N SER 99.A OG no hydrogen 3.150 N/A TYR 103.A N SER 99.A O no hydrogen 2.954 N/A TYR 103.A OH GLU 75.A OE2 no hydrogen 2.617 N/A LEU 104.A N LEU 100.A O no hydrogen 2.868 N/A THR 105.A N VAL 102.A O no hydrogen 3.050 N/A THR 105.A OG1 GLU 101.A O no hydrogen 2.745 N/A THR 108.A OG1 LEU 104.A O no hydrogen 3.498 N/A GLY 109.A N TYR 103.A O no hydrogen 2.881 N/A CYS 110.A SG THR 108.A O no hydrogen 4.024 N/A LYS 112.A NZ VAL 102.A O no hydrogen 2.873 N/A LYS 112.A NZ TYR 103.A O no hydrogen 3.257 N/A LYS 112.A NZ THR 105.A O no hydrogen 2.789 N/A LYS 112.A NZ PRO 107.A O no hydrogen 2.850 N/A LYS 112.A NZ CYS 110.A O no hydrogen 2.842 N/A LYS 113.A N HIS 137.A O no hydrogen 2.799 N/A LYS 113.A NZ GLU 91.A OE1 no hydrogen 2.812 N/A LYS 113.A NZ LYS 92.A O no hydrogen 2.842 N/A TYR 116.A N ASN 134.A O no hydrogen 2.888 N/A VAL 118.A N TYR 132.A O no hydrogen 2.889 N/A GLU 119.A N HIS 188.A O no hydrogen 2.867 N/A VAL 120.A N MET 130.A O no hydrogen 2.955 N/A GLN 121.A N GLU 186.A O no hydrogen 2.931 N/A PHE 122.A N ASN 128.A O no hydrogen 2.926 N/A ASP 123.A N VAL 184.A O no hydrogen 2.936 N/A ASP 125.A N PHE 122.A O no hydrogen 3.132 N/A ASN 128.A N ASP 125.A O no hydrogen 2.932 N/A ASN 128.A ND2 TYR 179.A O no hydrogen 3.101 N/A THR 129.A OG1 ILE 126.A O no hydrogen 2.772 N/A MET 130.A N VAL 120.A O no hydrogen 2.910 N/A TYR 132.A N VAL 118.A O no hydrogen 2.853 N/A TYR 132.A OH ASP 175.A OD2 no hydrogen 2.617 N/A ASN 134.A N TYR 116.A O no hydrogen 2.886 N/A TRP 135.A NE1 ALA 106.A O no hydrogen 3.059 N/A THR 136.A N HIS 114.A O no hydrogen 3.164 N/A THR 136.A OG1 HIS 137.A ND1 no hydrogen 2.678 N/A HIS 137.A N LYS 113.A O no hydrogen 3.252 N/A HIS 137.A ND1 THR 136.A OG1 no hydrogen 2.678 N/A ILE 138.A N VAL 149.A O no hydrogen 2.893 N/A TYR 139.A N ILE 111.A O no hydrogen 2.885 N/A TYR 139.A OH GLU 91.A OE1 no hydrogen 2.668 N/A ILE 140.A N THR 147.A O no hydrogen 2.769 N/A GLU 142.A N SER 145.A O no hydrogen 3.036 N/A SER 145.A N GLU 142.A O no hydrogen 3.021 N/A SER 145.A OG GLU 142.A O no hydrogen 2.685 N/A SER 145.A OG GLU 143.A OE1 no hydrogen 3.209 N/A THR 147.A N ILE 140.A O no hydrogen 2.945 N/A VAL 148.A N TYR 88.A OH no hydrogen 3.150 N/A VAL 149.A N ILE 138.A O no hydrogen 2.886 N/A GLY 151.A N TRP 135.A O no hydrogen 2.864 N/A GLN 152.A N TYR 159.A O no hydrogen 2.698 N/A ASP 154.A N GLY 157.A O no hydrogen 3.039 N/A TYR 155.A OH LYS 183.A O no hydrogen 3.082 N/A TYR 156.A N ASP 154.A OD1 no hydrogen 2.858 N/A GLY 157.A N ASP 154.A OD1 no hydrogen 3.097 N/A LEU 158.A N VAL 170.A O no hydrogen 2.968 N/A TYR 159.A N GLN 152.A O no hydrogen 2.925 N/A TYR 160.A N THR 167.A O no hydrogen 2.980 N/A HIS 162.A N ILE 165.A O no hydrogen 2.993 N/A HIS 162.A NE2 GLU 142.A OE1 no hydrogen 3.070 N/A ILE 165.A N HIS 162.A O no hydrogen 2.994 N/A ARG 166.A NH1 TYR 168.A OH no hydrogen 3.282 N/A THR 167.A N TYR 160.A O no hydrogen 2.898 N/A TYR 168.A OH ASP 154.A OD2 no hydrogen 2.596 N/A PHE 169.A N LEU 158.A O no hydrogen 2.832 N/A VAL 170.A N LEU 158.A O no hydrogen 3.317 N/A PHE 172.A N TYR 156.A O no hydrogen 2.855 N/A ASP 174.A N GLN 171.A O no hydrogen 3.039 N/A ALA 176.A N PHE 172.A O no hydrogen 3.010 N/A GLU 177.A N LYS 173.A O no hydrogen 2.943 N/A LYS 178.A N ASP 175.A O no hydrogen 3.109 N/A TYR 179.A N ASP 175.A O no hydrogen 2.879 N/A SER 180.A N ALA 176.A O no hydrogen 2.806 N/A ASN 182.A N SER 180.A OG no hydrogen 3.259 N/A TRP 185.A N TYR 155.A OH no hydrogen 3.087 N/A TRP 185.A NE1 TYR 155.A O no hydrogen 2.813 N/A GLU 186.A N GLN 121.A O no hydrogen 2.975 N/A VAL 187.A N ILE 194.A O no hydrogen 3.016 N/A HIS 188.A N GLU 119.A O no hydrogen 2.704 N/A ALA 189.A N GLN 192.A O no hydrogen 3.449 N/A ILE 194.A N VAL 187.A O no hydrogen 2.827 N/A CYS 196.A SG THR 198.A O no hydrogen 3.754 N/A THR 198.A OG1 SER 199.A O no hydrogen 3.385 N/A