Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pyi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ GLU 53.A OE2 no hydrogen 3.063 N/A ILE 4.A N GLU 39.A O no hydrogen 2.792 N/A LEU 6.A N ILE 37.A O no hydrogen 2.800 N/A PHE 7.A N ILE 37.A O no hydrogen 3.004 N/A GLN 9.A N LEU 35.A O no hydrogen 3.064 N/A LEU 11.A N VAL 33.A O no hydrogen 2.834 N/A ILE 12.A N ASN 101.A O no hydrogen 3.163 N/A ALA 13.A N THR 31.A O no hydrogen 2.905 N/A SER 14.A N ILE 107.A O no hydrogen 2.858 N/A LEU 15.A N TYR 29.A O no hydrogen 2.789 N/A LEU 16.A N ILE 109.A O no hydrogen 2.796 N/A GLN 17.A N LYS 27.A O no hydrogen 3.125 N/A LEU 19.A N ASP 25.A O no hydrogen 2.899 N/A SER 20.A N GLN 23.A O no hydrogen 3.285 N/A SER 20.A OG GLN 23.A OE1 no hydrogen 3.252 N/A ASN 22.A N SER 20.A OG no hydrogen 3.221 N/A GLN 23.A N SER 20.A O no hydrogen 3.224 N/A LYS 27.A N GLN 17.A O no hydrogen 2.854 N/A TYR 29.A N LEU 15.A O no hydrogen 3.017 N/A THR 31.A N ALA 13.A O no hydrogen 2.879 N/A THR 31.A OG1 LYS 32.A O no hydrogen 3.401 N/A VAL 33.A N LEU 11.A O no hydrogen 2.829 N/A LYS 34.A N SER 55.A O no hydrogen 2.800 N/A LEU 35.A N GLN 9.A O no hydrogen 2.857 N/A LYS 36.A N GLU 53.A O no hydrogen 2.819 N/A ILE 37.A N PHE 7.A O no hydrogen 2.770 N/A SER 38.A N LYS 51.A O no hydrogen 3.002 N/A GLU 39.A N ILE 4.A O no hydrogen 2.899 N/A GLN 40.A N GLU 49.A O no hydrogen 2.864 N/A GLN 40.A NE2 GLU 49.A OE1 no hydrogen 3.001 N/A ARG 41.A N SER 2.A OG no hydrogen 2.936 N/A ASN 42.A N GLU 47.A O no hydrogen 2.814 N/A ASN 42.A ND2 GLU 49.A OE2 no hydrogen 2.580 N/A THR 44.A N ASN 42.A OD1 no hydrogen 2.987 N/A THR 44.A OG1 ASN 42.A OD1 no hydrogen 2.701 N/A SER 45.A N ASN 42.A OD1 no hydrogen 2.876 N/A SER 45.A OG GLU 47.A OE2 no hydrogen 3.331 N/A GLY 46.A N ASN 42.A O no hydrogen 2.773 N/A GLU 47.A N SER 45.A OG no hydrogen 3.156 N/A LYS 48.A NZ ASP 87.A OD1.A no hydrogen 2.741 N/A GLU 49.A N GLN 40.A O no hydrogen 2.676 N/A LEU 50.A N LEU 68.A O no hydrogen 2.741 N/A LYS 51.A N SER 38.A O no hydrogen 2.807 N/A PHE 52.A N GLU 66.A O no hydrogen 2.812 N/A GLU 53.A N LYS 36.A O no hydrogen 2.878 N/A ILE 54.A N PHE 64.A O no hydrogen 2.798 N/A SER 55.A N LYS 34.A O no hydrogen 3.104 N/A ARG 56.A NH1 THR 31.A OG1 no hydrogen 3.008 N/A ASP 59.A N ARG 56.A O no hydrogen 3.321 N/A GLU 61.A N ASP 59.A OD1 no hydrogen 2.777 N/A PHE 62.A N ASP 59.A O no hydrogen 2.554 N/A LEU 63.A N GLU 61.A O no hydrogen 3.153 N/A PHE 64.A N ILE 54.A O no hydrogen 3.005 N/A SER 65.A N HIS 139.A O no hydrogen 2.986 N/A GLU 66.A N PHE 52.A O no hydrogen 2.908 N/A THR 67.A N GLU 66.A OE1 no hydrogen 2.824 N/A LEU 68.A N LEU 50.A O no hydrogen 2.677 N/A ASN 69.A ND2 GLU 47.A OE2 no hydrogen 3.306 N/A LYS 72.A N ASN 69.A OD1 no hydrogen 2.816 N/A LYS 72.A NZ GLU 66.A OE1 no hydrogen 3.324 N/A LYS 72.A NZ GLU 66.A OE2 no hydrogen 3.134 N/A LYS 72.A NZ THR 67.A O no hydrogen 2.867 N/A TYR 73.A N ASN 69.A O no hydrogen 2.882 N/A TYR 73.A OH VAL 84.A O no hydrogen 2.726 N/A GLN 74.A N ASN 70.A O no hydrogen 2.964 N/A GLN 74.A NE2 ASN 70.A OD1 no hydrogen 3.463 N/A ILE 75.A N GLU 71.A O no hydrogen 3.311 N/A LEU 76.A N LYS 72.A O no hydrogen 3.185 N/A ALA 77.A N TYR 73.A O no hydrogen 2.753 N/A ARG 78.A N GLN 74.A O no hydrogen 2.963 N/A ASP 79.A N ILE 75.A O no hydrogen 2.883 N/A HIS 80.A N LEU 76.A O no hydrogen 3.015 N/A HIS 80.A ND1 LEU 76.A O no hydrogen 3.149 N/A LEU 82.A N ALA 77.A O no hydrogen 2.900 N/A ALA 88.A N ASP 85.A OD1 no hydrogen 2.744 N/A PHE 89.A N ASP 85.A O no hydrogen 2.897 N/A VAL 92.A N ALA 88.A O no hydrogen 2.979 N/A ILE 93.A N PHE 89.A O no hydrogen 3.135 N/A ILE 94.A N PRO 90.A O no hydrogen 3.015 N/A GLN 95.A N LYS 91.A O no hydrogen 2.918 N/A HIS 96.A N VAL 92.A O no hydrogen 2.661 N/A LEU 97.A N ILE 93.A O no hydrogen 2.915 N/A LEU 98.A N ILE 93.A O no hydrogen 2.632 N/A CYS 99.A SG.A ILE 94.A O no hydrogen 3.967 N/A CYS 99.A SG.A GLN 95.A O no hydrogen 3.750 N/A CYS 99.A SG.B ILE 94.A O no hydrogen 3.142 N/A ASN 101.A N LEU 98.A O no hydrogen 2.980 N/A ASN 101.A ND2 THR 105.A O no hydrogen 2.600 N/A VAL 103.A N THR 10.A O no hydrogen 2.761 N/A THR 105.A OG1 LEU 97.A O no hydrogen 2.870 N/A GLU 106.A N PHE 123.A O no hydrogen 2.965 N/A ASN 108.A N GLU 121.A O no hydrogen 2.920 N/A ILE 109.A N SER 14.A O no hydrogen 2.795 N/A ILE 110.A N SER 119.A O no hydrogen 2.966 N/A LEU 111.A N LEU 16.A O no hydrogen 2.865 N/A ASP 112.A N PHE 117.A O no hydrogen 2.821 N/A LYS 115.A N ASP 112.A O no hydrogen 3.282 N/A LYS 115.A NZ ASP 59.A OD2 no hydrogen 2.712 N/A LYS 115.A NZ GLU 61.A OE1 no hydrogen 2.817 N/A CYS 118.A N LEU 138.A O no hydrogen 2.969 N/A SER 119.A N ILE 110.A O no hydrogen 2.835 N/A SER 119.A OG GLU 121.A OE2 no hydrogen 3.095 N/A PHE 120.A N ILE 136.A O no hydrogen 2.794 N/A GLU 121.A N ASN 108.A O no hydrogen 2.760 N/A LEU 122.A N PHE 134.A O no hydrogen 3.041 N/A PHE 123.A N GLU 106.A O no hydrogen 2.795 N/A SER 124.A N GLY 131.A O no hydrogen 2.707 N/A THR 126.A N SER 129.A O no hydrogen 2.966 N/A THR 126.A OG1 SER 129.A OG no hydrogen 2.593 N/A ILE 128.A N THR 126.A OG1 no hydrogen 3.044 N/A SER 129.A OG THR 126.A OG1 no hydrogen 2.593 N/A LYS 132.A NZ GLU 121.A OE2 no hydrogen 3.347 N/A ILE 133.A N LEU 122.A O no hydrogen 2.719 N/A SER 135.A N HIS 80.A NE2 no hydrogen 3.391 N/A ILE 136.A N PHE 120.A O no hydrogen 2.887 N/A LEU 138.A N CYS 118.A O no hydrogen 2.735 N/A HIS 139.A N SER 65.A O no hydrogen 2.929 N/A ALA 140.A N ASN 116.A O no hydrogen 2.885 N/A VAL 141.A N LEU 63.A O no hydrogen 2.751 N/A ARG 142.A NH1 GLU 61.A O no hydrogen 3.258 N/A ARG 142.A NH1 LYS 115.A O no hydrogen 2.763 N/A ARG 142.A NH2 LYS 115.A O no hydrogen 3.257 N/A