Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3piv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 GLU 95.A OE2 no hydrogen 3.066 N/A LEU 4.A N CYS 1.A O no hydrogen 3.364 N/A GLY 5.A N GLU 2.A O no hydrogen 3.008 N/A ARG 8.A NH1 ASP 149.A OD2 no hydrogen 3.075 N/A ILE 9.A N ARG 6.A O no hydrogen 2.904 N/A THR 11.A N TYR 7.A O no hydrogen 3.004 N/A THR 11.A OG1 TYR 7.A O no hydrogen 3.412 N/A THR 11.A OG1 ASP 149.A OD1 no hydrogen 2.730 N/A THR 12.A N ARG 8.A O no hydrogen 2.816 N/A THR 12.A OG1 ARG 8.A O no hydrogen 3.124 N/A GLU 13.A N ILE 9.A O no hydrogen 3.001 N/A SER 14.A N ILE 10.A O no hydrogen 2.883 N/A SER 14.A OG ILE 10.A O no hydrogen 2.817 N/A SER 14.A OG THR 11.A O no hydrogen 3.216 N/A LEU 15.A N THR 11.A O no hydrogen 2.998 N/A ASN 16.A N THR 12.A O no hydrogen 2.879 N/A ASN 16.A ND2 THR 12.A O no hydrogen 3.575 N/A LEU 17.A N GLU 13.A O no hydrogen 2.982 N/A LEU 18.A N SER 14.A O no hydrogen 2.890 N/A LYS 19.A N LEU 15.A O no hydrogen 2.885 N/A ASN 20.A N ASN 16.A O no hydrogen 2.858 N/A MET 21.A N LEU 17.A O no hydrogen 2.934 N/A GLU 29.A N GLN 136.A OE1 no hydrogen 2.825 N/A THR 30.A OG1 GLN 136.A OE1 no hydrogen 2.652 N/A SER 34.A N PHE 32.A O no hydrogen 2.844 N/A TYR 37.A N PRO 33.A O no hydrogen 3.093 N/A TYR 37.A OH HIS 144.A ND1 no hydrogen 2.760 N/A THR 38.A N SER 34.A O no hydrogen 2.893 N/A THR 38.A OG1 SER 34.A O no hydrogen 3.121 N/A LEU 39.A N ARG 35.A O no hydrogen 3.188 N/A MET 40.A N LEU 36.A O no hydrogen 2.875 N/A ASP 41.A N TYR 37.A O no hydrogen 2.727 N/A LYS 42.A N LEU 39.A O no hydrogen 3.223 N/A SER 43.A N MET 40.A O no hydrogen 3.195 N/A SER 43.A OG LEU 39.A O no hydrogen 2.823 N/A GLN 48.A N LYS 44.A O no hydrogen 2.999 N/A GLN 48.A NE2 MET 40.A O no hydrogen 3.008 N/A VAL 49.A N VAL 45.A O no hydrogen 2.998 N/A LYS 50.A N GLU 46.A O no hydrogen 3.143 N/A LYS 50.A NZ ALA 101.A O no hydrogen 3.362 N/A PHE 51.A N ASP 47.A O no hydrogen 2.916 N/A LEU 52.A N GLN 48.A O no hydrogen 2.833 N/A VAL 53.A N VAL 49.A O no hydrogen 2.970 N/A LEU 54.A N LYS 50.A O no hydrogen 2.970 N/A THR 55.A N PHE 51.A O no hydrogen 3.015 N/A THR 55.A OG1 PHE 51.A O no hydrogen 2.714 N/A LEU 56.A N LEU 52.A O no hydrogen 2.861 N/A ASP 57.A N VAL 53.A O no hydrogen 3.004 N/A HIS 58.A N LEU 54.A O no hydrogen 3.037 N/A ILE 59.A N THR 55.A O no hydrogen 2.904 N/A ILE 60.A N LEU 56.A O no hydrogen 2.936 N/A HIS 61.A N ASP 57.A O no hydrogen 2.988 N/A LEU 62.A N HIS 58.A O no hydrogen 2.887 N/A MET 63.A N ILE 59.A O no hydrogen 3.013 N/A MET 63.A N ILE 60.A O no hydrogen 3.246 N/A ASP 64.A N ILE 60.A O no hydrogen 3.007 N/A ALA 65.A N MET 63.A O no hydrogen 2.834 N/A ARG 66.A NH1 GLN 76.A OE1 no hydrogen 3.272 N/A GLU 67.A N GLU 67.A OE1 no hydrogen 2.757 N/A HIS 68.A N ALA 65.A O no hydrogen 2.710 N/A MET 69.A N ARG 66.A O no hydrogen 3.113 N/A SER 71.A OG TYR 129.A O no hydrogen 3.236 N/A VAL 72.A N MET 69.A O no hydrogen 3.071 N/A TRP 74.A NE1 GLU 135.A OE2 no hydrogen 2.932 N/A ASP 75.A N MET 21.A O no hydrogen 2.938 N/A THR 78.A N ASP 75.A OD2 no hydrogen 3.098 N/A THR 78.A OG1 ASP 75.A OD2 no hydrogen 2.890 N/A VAL 79.A N ASP 75.A O no hydrogen 3.006 N/A GLU 80.A N GLN 76.A O no hydrogen 2.917 N/A ASP 81.A N ASN 77.A O no hydrogen 2.960 N/A PHE 82.A N THR 78.A O no hydrogen 2.908 N/A LEU 83.A N VAL 79.A O no hydrogen 2.905 N/A ASN 84.A N GLU 80.A O no hydrogen 2.974 N/A ASN 84.A ND2 GLU 80.A OE2 no hydrogen 3.208 N/A ILE 85.A N ASP 81.A O no hydrogen 2.848 N/A LEU 86.A N PHE 82.A O no hydrogen 3.251 N/A HIS 87.A N LEU 83.A O no hydrogen 2.919 N/A ARG 88.A N ASN 84.A O no hydrogen 3.029 N/A LYS 89.A N ILE 85.A O no hydrogen 3.390 N/A LYS 89.A NZ TRP 3.A O no hydrogen 3.301 N/A SER 90.A N LEU 86.A O no hydrogen 2.993 N/A SER 90.A OG ASP 57.A OD1 no hydrogen 2.733 N/A SER 91.A N HIS 87.A O no hydrogen 2.773 N/A ASP 92.A N ARG 88.A O no hydrogen 3.090 N/A LEU 93.A N LYS 89.A O no hydrogen 2.979 N/A LYS 94.A N SER 90.A O no hydrogen 2.944 N/A LYS 94.A NZ ASP 57.A OD2 no hydrogen 2.482 N/A LYS 94.A NZ SER 90.A OG no hydrogen 3.192 N/A GLU 95.A N ASP 92.A O no hydrogen 3.012 N/A VAL 97.A N LEU 93.A O no hydrogen 3.084 N/A ALA 98.A N LYS 94.A O no hydrogen 3.022 N/A ARG 99.A N CYS 96.A O no hydrogen 2.901 N/A TYR 100.A N VAL 97.A O no hydrogen 3.000 N/A TYR 109.A OH ASP 47.A OD1 no hydrogen 2.771 N/A ILE 111.A N GLU 107.A O no hydrogen 3.367 N/A ARG 112.A N SER 108.A O no hydrogen 2.865 N/A ILE 113.A N TYR 109.A O no hydrogen 2.912 N/A LYS 114.A N GLU 110.A O no hydrogen 3.126 N/A ARG 115.A N ILE 111.A O no hydrogen 2.929 N/A HIS 116.A N ARG 112.A O no hydrogen 2.860 N/A HIS 116.A NE2 HIS 144.A NE2 no hydrogen 2.709 N/A PHE 117.A N ILE 113.A O no hydrogen 3.024 N/A ARG 118.A N LYS 114.A O no hydrogen 2.899 N/A THR 119.A N ARG 115.A O no hydrogen 3.096 N/A THR 119.A OG1 ARG 115.A O no hydrogen 3.129 N/A LEU 120.A N HIS 116.A O no hydrogen 3.098 N/A LYS 121.A N PHE 117.A O no hydrogen 3.031 N/A LYS 122.A N ARG 118.A O no hydrogen 2.906 N/A ILE 123.A N THR 119.A O no hydrogen 2.902 N/A LEU 124.A N LEU 120.A O no hydrogen 3.072 N/A LYS 125.A N LYS 121.A O no hydrogen 3.057 N/A LYS 126.A N LYS 122.A O no hydrogen 2.961 N/A LYS 127.A N ILE 123.A O no hydrogen 3.114 N/A GLN 128.A N LYS 125.A O no hydrogen 2.865 N/A TYR 129.A N LEU 124.A O no hydrogen 2.682 N/A SER 130.A N LYS 127.A O no hydrogen 3.190 N/A ALA 133.A N SER 130.A OG no hydrogen 3.022 N/A TRP 134.A N SER 130.A O no hydrogen 3.017 N/A TRP 134.A NE1 HIS 68.A O no hydrogen 2.649 N/A GLU 135.A N ALA 131.A O no hydrogen 2.833 N/A GLN 136.A N GLU 132.A O no hydrogen 2.956 N/A GLN 136.A NE2 ASP 27.A O no hydrogen 2.861 N/A GLN 136.A NE2 GLU 132.A OE1 no hydrogen 3.184 N/A ILE 137.A N ALA 133.A O no hydrogen 3.071 N/A ARG 138.A N TRP 134.A O no hydrogen 2.839 N/A ARG 138.A NE LEU 18.A O no hydrogen 2.852 N/A ARG 138.A NH1 GLY 23.A O no hydrogen 3.216 N/A ARG 138.A NH1 GLU 135.A OE1 no hydrogen 3.001 N/A ARG 138.A NH2 LEU 18.A O no hydrogen 2.833 N/A ARG 138.A NH2 GLY 23.A O no hydrogen 2.878 N/A ARG 139.A N GLU 135.A O no hydrogen 2.898 N/A ARG 139.A NH1 ARG 139.A O no hydrogen 2.837 N/A ARG 139.A NH1 SER 143.A OG no hydrogen 2.741 N/A VAL 140.A N GLN 136.A O no hydrogen 2.823 N/A VAL 141.A N ILE 137.A O no hydrogen 2.856 N/A LYS 142.A N ARG 138.A O no hydrogen 3.096 N/A SER 143.A N ARG 139.A O no hydrogen 3.249 N/A HIS 144.A N VAL 140.A O no hydrogen 3.069 N/A HIS 144.A ND1 TYR 37.A OH no hydrogen 2.760 N/A HIS 144.A NE2 HIS 116.A NE2 no hydrogen 2.709 N/A LEU 145.A N VAL 141.A O no hydrogen 2.938 N/A GLN 146.A N LYS 142.A O no hydrogen 3.054 N/A ARG 147.A N SER 143.A O no hydrogen 3.137 N/A ARG 147.A NH2 ASP 41.A OD2 no hydrogen 2.891 N/A MET 148.A N HIS 144.A O no hydrogen 2.750 N/A ASP 149.A N LEU 145.A O no hydrogen 3.248 N/A ILE 151.A N ARG 147.A O no hydrogen 3.108 N/A ALA 152.A N MET 148.A O no hydrogen 2.861 N/A SER 153.A N ASP 149.A O no hydrogen 2.908 N/A SER 153.A OG ASP 149.A O no hydrogen 3.206 N/A ASN 154.A N ILE 150.A O no hydrogen 2.851 N/A ALA 155.A N ILE 151.A O no hydrogen 2.776 N/A ARG 156.A N ALA 152.A O no hydrogen 2.941 N/A