Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xtd_BBB.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLU 12.A O no hydrogen 3.025 N/A ASP 5.A N THR 10.A O no hydrogen 2.844 N/A TYR 7.A N ASP 5.A OD1 no hydrogen 2.798 N/A ASP 8.A N ASP 5.A OD1 no hydrogen 3.076 N/A GLY 9.A N ASP 5.A O no hydrogen 2.806 N/A THR 10.A N ASP 8.A OD1 no hydrogen 3.022 N/A THR 10.A OG1 ASP 8.A OD1 no hydrogen 2.910 N/A LEU 11.A N LEU 18.A O no hydrogen 2.810 N/A GLU 12.A N GLN 3.A O no hydrogen 3.014 N/A LEU 13.A N ILE 16.A O no hydrogen 2.960 N/A ILE 16.A N LEU 13.A O no hydrogen 2.763 N/A LEU 18.A N LEU 11.A O no hydrogen 2.827 N/A GLY 19.A N THR 22.A OG1 no hydrogen 2.923 N/A THR 22.A N GLY 19.A O no hydrogen 3.065 N/A THR 22.A OG1 GLY 19.A O no hydrogen 3.185 N/A ARG 24.A N ALA 76.A O no hydrogen 3.141 N/A ARG 24.A NE TYR 48.A OH no hydrogen 2.860 N/A ARG 24.A NH1 GLY 70.A O no hydrogen 2.826 N/A ARG 24.A NH1 ILE 73.A O no hydrogen 2.934 N/A ARG 24.A NH2 THR 45.A O no hydrogen 2.904 N/A ARG 24.A NH2 TYR 48.A OH no hydrogen 3.326 N/A ARG 24.A NH2 GLY 70.A O no hydrogen 3.054 N/A GLU 25.A N THR 74.A O no hydrogen 3.081 N/A MET 26.A N THR 23.A OG1 no hydrogen 3.240 N/A LEU 27.A N THR 23.A O no hydrogen 3.021 N/A ILE 28.A N ARG 24.A O no hydrogen 2.929 N/A ARG 32.A NH2 THR 50.A OG1 no hydrogen 2.814 N/A ARG 32.A NH2 ILE 51.A O no hydrogen 3.087 N/A GLU 35.A N ARG 49.A O no hydrogen 2.946 N/A GLY 36.A N GLU 39.A OE2 no hydrogen 2.877 N/A TRP 37.A N SER 47.A O no hydrogen 2.843 N/A LYS 40.A N THR 45.A OG1 no hydrogen 3.052 N/A GLY 43.A N LYS 40.A O no hydrogen 2.980 N/A ARG 44.A N ASP 42.A OD1 no hydrogen 2.960 N/A SER 47.A OG ASP 67.A OD1 no hydrogen 2.566 N/A TYR 48.A N ALA 66.A O no hydrogen 2.911 N/A ARG 49.A N GLU 35.A O no hydrogen 2.834 N/A ARG 49.A NE GLU 35.A OE2 no hydrogen 3.037 N/A ARG 49.A NH2 GLU 35.A OE2 no hydrogen 2.751 N/A THR 50.A N ILE 64.A O no hydrogen 2.956 N/A THR 50.A OG1 LEU 33.A O no hydrogen 2.713 N/A ILE 52.A N ILE 62.A O no hydrogen 2.805 N/A LYS 58.A NZ GLU 110.A OE1.A no hydrogen 3.314 N/A LYS 58.A NZ GLU 110.A OE2.A no hydrogen 2.616 N/A ALA 59.A N GLU 57.A OE2 no hydrogen 2.990 N/A GLY 60.A N GLU 57.A O no hydrogen 3.093 N/A ILE 62.A N ILE 52.A O no hydrogen 2.958 N/A TYR 63.A N ALA 84.A O no hydrogen 2.910 N/A TYR 63.A OH GLU 86.A OE2 no hydrogen 3.221 N/A ILE 64.A N THR 50.A O no hydrogen 2.931 N/A ILE 65.A N ARG 82.A O no hydrogen 2.928 N/A ALA 66.A N TYR 48.A O no hydrogen 2.854 N/A ASP 67.A N SER 80.A O no hydrogen 2.942 N/A PHE 68.A N THR 46.A O no hydrogen 2.822 N/A SER 69.A N VAL 77.A O no hydrogen 3.083 N/A SER 69.A OG.A VAL 77.A O no hydrogen 3.567 N/A ILE 73.A N ALA 71.A O no hydrogen 2.863 N/A ALA 76.A N ILE 73.A O no hydrogen 3.388 N/A VAL 77.A N SER 69.A OG.A no hydrogen 3.287 N/A LEU 78.A N THR 22.A O no hydrogen 2.939 N/A CYS 79.A N ASP 67.A O no hydrogen 2.826 N/A CYS 79.A SG.A ASP 67.A O no hydrogen 3.455 N/A CYS 79.A SG.B SER 69.A OG.B no hydrogen 1.971 N/A CYS 79.A SG.B VAL 77.A O no hydrogen 3.919 N/A CYS 79.A SG.B SER 144.A O no hydrogen 3.773 N/A SER 80.A OG ASP 67.A OD2 no hydrogen 2.707 N/A TRP 81.A N CYS 140.A O no hydrogen 3.103 N/A TRP 81.A NE1 TYR 142.A OH no hydrogen 2.920 N/A ARG 82.A N ILE 65.A O no hydrogen 2.913 N/A PHE 83.A N ILE 138.A O no hydrogen 2.982 N/A ALA 84.A N TYR 63.A O no hydrogen 3.044 N/A GLU 86.A N ASP 61.A O no hydrogen 2.742 N/A LYS 87.A N ALA 59.A O no hydrogen 2.897 N/A LEU 88.A N PRO 85.A O no hydrogen 2.959 N/A MET 89.A N GLU 86.A O no hydrogen 3.293 N/A GLY 91.A N LEU 134.A O no hydrogen 3.199 N/A GLN 93.A N TYR 129.A OH no hydrogen 3.101 N/A GLN 93.A NE2 LYS 95.A O no hydrogen 2.959 N/A GLY 98.A N THR 101.A OG1 no hydrogen 3.275 N/A THR 101.A N GLN 93.A OE1 no hydrogen 2.967 N/A THR 101.A OG1 GLN 93.A OE1 no hydrogen 3.512 N/A THR 101.A OG1 GLU 97.A OE1 no hydrogen 2.753 N/A THR 101.A OG1 GLY 98.A O no hydrogen 3.212 N/A LYS 102.A N GLY 98.A O no hydrogen 2.929 N/A ASN 103.A N ALA 99.A O no hydrogen 2.848 N/A LEU 104.A N ILE 100.A O no hydrogen 3.069 N/A ARG 105.A N THR 101.A O no hydrogen 3.034 N/A ARG 105.A NE ASP 126.A OD1 no hydrogen 2.842 N/A ARG 105.A NH1 GLU 97.A OE1 no hydrogen 2.812 N/A ARG 105.A NH2 GLU 97.A OE1 no hydrogen 3.413 N/A ARG 105.A NH2 GLU 97.A OE2 no hydrogen 2.848 N/A ARG 105.A NH2 ASP 126.A OD1 no hydrogen 3.375 N/A ARG 105.A NH2 ASP 126.A OD2 no hydrogen 3.168 N/A THR 106.A N LYS 102.A O no hydrogen 2.965 N/A THR 106.A OG1 LYS 102.A O no hydrogen 3.153 N/A TRP 107.A N ASN 103.A O no hydrogen 2.989 N/A TRP 107.A NE1 GLU 57.A OE2 no hydrogen 2.938 N/A PHE 108.A N LEU 104.A O no hydrogen 2.934 N/A TYR 109.A N ARG 105.A O no hydrogen 2.889 N/A GLU 110.A N THR 106.A O no hydrogen 2.905 N/A LYS 111.A N TRP 107.A O no hydrogen 3.050 N/A LYS 111.A NZ GLU 57.A OE1 no hydrogen 2.711 N/A THR 112.A N PHE 108.A O no hydrogen 2.923 N/A THR 112.A OG1 PHE 108.A O no hydrogen 2.769 N/A HIS 113.A N TYR 109.A O no hydrogen 2.755 N/A ILE 114.A N THR 112.A OG1 no hydrogen 2.992 N/A GLN 115.A NE2 LEU 116.A O no hydrogen 2.926 N/A VAL 118.A N ILE 125.A O no hydrogen 3.036 N/A GLY 120.A N GLY 123.A O no hydrogen 2.989 N/A GLY 123.A N GLY 120.A O no hydrogen 3.145 N/A HIS 124.A N ASN 141.A O no hydrogen 2.951 N/A HIS 124.A ND1 TYR 155.A OH no hydrogen 2.764 N/A ILE 125.A N VAL 118.A O no hydrogen 2.838 N/A ASP 126.A N VAL 139.A O no hydrogen 3.031 N/A ALA 127.A N ASP 126.A OD1 no hydrogen 2.815 N/A ALA 128.A N THR 137.A O no hydrogen 2.898 N/A TYR 129.A OH GLY 91.A O no hydrogen 2.538 N/A ASP 130.A N THR 135.A O no hydrogen 2.701 N/A HIS 132.A N ASP 130.A OD1 no hydrogen 2.815 N/A ASN 133.A N ASP 130.A OD1 no hydrogen 2.971 N/A ASN 133.A ND2 ASP 130.A OD2 no hydrogen 3.293 N/A LEU 134.A N ASP 130.A O no hydrogen 2.840 N/A THR 135.A N ASP 130.A O no hydrogen 3.324 N/A GLY 136.A N MET 89.A O no hydrogen 2.784 N/A THR 137.A N ALA 128.A O no hydrogen 3.018 N/A ILE 138.A N PHE 83.A O no hydrogen 2.834 N/A VAL 139.A N ASP 126.A O no hydrogen 2.843 N/A CYS 140.A N TRP 81.A O no hydrogen 2.789 N/A ASN 141.A N HIS 124.A O no hydrogen 2.929 N/A ASN 141.A ND2 TYR 155.A OH no hydrogen 2.984 N/A TYR 142.A N CYS 79.A O no hydrogen 2.990 N/A TYR 142.A OH GLY 9.A O no hydrogen 2.704 N/A TYR 142.A OH LEU 18.A O no hydrogen 3.173 N/A ARG 143.A N TRP 122.A O no hydrogen 2.996 N/A ARG 143.A NH1 ARG 143.A O no hydrogen 2.970 N/A ARG 143.A NH1 PHE 146.A O no hydrogen 2.925 N/A ARG 143.A NH2 GLU 149.A OE1 no hydrogen 2.889 N/A SER 144.A OG LEU 78.A O no hydrogen 3.451 N/A ALA 145.A N TYR 142.A O no hydrogen 2.915 N/A PHE 146.A N ARG 143.A O no hydrogen 3.024 N/A THR 148.A OG1 ASP 150.A OD1.A no hydrogen 2.828 N/A THR 148.A OG1 GLU 151.A OE2.A no hydrogen 2.942 N/A GLU 151.A N.A THR 148.A OG1 no hydrogen 3.086 N/A GLU 151.A N.B THR 148.A OG1 no hydrogen 3.109 N/A TRP 152.A N THR 148.A O no hydrogen 3.218 N/A TRP 152.A NE1 TYR 163.A OH no hydrogen 3.025 N/A ARG 153.A N GLU 149.A O no hydrogen 2.873 N/A ARG 153.A NE GLU 149.A OE2 no hydrogen 2.939 N/A LYS 154.A N ASP 150.A O no hydrogen 2.902 N/A LYS 154.A NZ ASP 150.A OD1.B no hydrogen 2.396 N/A LYS 154.A NZ ASP 150.A OD2.A no hydrogen 3.448 N/A LYS 154.A NZ ASP 150.A OD2.B no hydrogen 2.232 N/A TYR 155.A N GLU 151.A O.A no hydrogen 2.952 N/A TYR 155.A N GLU 151.A O.B no hydrogen 2.924 N/A TYR 155.A OH HIS 124.A ND1 no hydrogen 2.764 N/A CYS 156.A N TRP 152.A O no hydrogen 2.891 N/A CYS 156.A SG TRP 152.A O no hydrogen 3.410 N/A LYS 157.A N ARG 153.A O no hydrogen 3.016 N/A ARG 158.A N LYS 154.A O no hydrogen 2.991 N/A ASN 159.A N TYR 155.A O no hydrogen 2.909 N/A ASN 159.A ND2 TYR 155.A O no hydrogen 3.020 N/A ILE 161.A N CYS 156.A O no hydrogen 2.939 N/A