Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pxu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASP 30.A OD2 no hydrogen 2.581 N/A ALA 5.A N THR 31.A O no hydrogen 3.032 N/A VAL 6.A N VAL 85.A O no hydrogen 2.853 N/A TYR 7.A N VAL 33.A O no hydrogen 2.774 N/A GLY 9.A N GLY 35.A O no hydrogen 3.024 N/A THR 10.A OG1 SER 39.A OG no hydrogen 2.696 N/A THR 15.A N HIS 18.A ND1 no hydrogen 2.956 N/A THR 15.A OG1 HIS 18.A ND1 no hydrogen 3.366 N/A ARG 16.A N PHE 142.A O no hydrogen 2.886 N/A ARG 16.A NE SER 140.A O no hydrogen 3.047 N/A ARG 16.A NE VAL 143.A O no hydrogen 3.276 N/A ARG 16.A NH2 SER 140.A O no hydrogen 2.885 N/A HIS 18.A N THR 15.A OG1 no hydrogen 3.163 N/A GLU 19.A N THR 15.A O no hydrogen 2.922 N/A ASP 20.A N ARG 16.A O no hydrogen 2.924 N/A LEU 21.A N GLY 17.A O no hydrogen 3.171 N/A VAL 22.A N HIS 18.A O no hydrogen 2.959 N/A ARG 23.A N GLU 19.A O no hydrogen 2.984 N/A ARG 23.A NH2 ASP 20.A OD1 no hydrogen 2.760 N/A ARG 24.A N ASP 20.A O no hydrogen 2.959 N/A ARG 24.A NE ASP 20.A OD2 no hydrogen 3.102 N/A ARG 24.A NH1 SER 118.A OG no hydrogen 3.059 N/A ALA 25.A N LEU 21.A O no hydrogen 2.800 N/A SER 26.A N VAL 22.A O no hydrogen 2.974 N/A SER 26.A OG VAL 22.A O no hydrogen 2.941 N/A SER 26.A OG ARG 23.A O no hydrogen 3.113 N/A SER 27.A N ARG 23.A O no hydrogen 3.245 N/A SER 27.A N ARG 24.A O no hydrogen 3.310 N/A SER 27.A OG ARG 24.A O no hydrogen 2.878 N/A ILE 28.A N ALA 25.A O no hydrogen 2.979 N/A PHE 29.A N ALA 25.A O no hydrogen 2.987 N/A ASP 30.A N VAL 3.A O no hydrogen 3.146 N/A LEU 32.A N ASN 64.A O no hydrogen 2.918 N/A VAL 33.A N ALA 5.A O no hydrogen 2.861 N/A VAL 34.A N LYS 66.A O no hydrogen 2.645 N/A GLY 35.A N TYR 7.A O no hydrogen 2.925 N/A VAL 36.A N MET 68.A O no hydrogen 2.749 N/A ALA 37.A N GLY 9.A O no hydrogen 2.920 N/A ASP 38.A N PHE 70.A O no hydrogen 2.854 N/A SER 39.A OG THR 10.A OG1 no hydrogen 2.696 N/A SER 39.A OG ALA 37.A O no hydrogen 3.306 N/A LYS 42.A N SER 39.A O no hydrogen 2.903 N/A LYS 42.A NZ THR 10.A OG1 no hydrogen 3.166 N/A LYS 43.A N ARG 40.A O no hydrogen 2.981 N/A PHE 45.A N ASP 12.A OD2 no hydrogen 2.677 N/A PHE 46.A N ASP 12.A OD1 no hydrogen 2.884 N/A SER 47.A N GLU 50.A OE1 no hydrogen 2.944 N/A GLU 50.A N SER 47.A OG no hydrogen 3.108 N/A ARG 51.A N SER 47.A O no hydrogen 2.858 N/A ARG 51.A NE PHE 46.A O no hydrogen 2.963 N/A ARG 51.A NE SER 47.A O no hydrogen 3.348 N/A ARG 51.A NH1 ASP 38.A O no hydrogen 2.785 N/A ARG 51.A NH2 THR 10.A O no hydrogen 2.860 N/A ARG 51.A NH2 ALA 37.A O no hydrogen 2.814 N/A LEU 52.A N LEU 48.A O no hydrogen 2.980 N/A LYS 53.A N GLU 49.A O no hydrogen 3.067 N/A ILE 54.A N GLU 50.A O no hydrogen 2.835 N/A ALA 55.A N ARG 51.A O no hydrogen 2.997 N/A ASN 56.A N LEU 52.A O no hydrogen 2.761 N/A ASN 56.A ND2 LEU 52.A O no hydrogen 3.347 N/A GLU 57.A N LYS 53.A O no hydrogen 2.910 N/A VAL 58.A N ILE 54.A O no hydrogen 3.383 N/A LEU 59.A N ALA 55.A O no hydrogen 2.815 N/A GLY 60.A N ASN 56.A O no hydrogen 2.877 N/A TYR 62.A N LEU 59.A O no hydrogen 2.932 N/A TYR 62.A OH GLU 19.A OE2 no hydrogen 2.577 N/A ASN 64.A ND2 SER 26.A O no hydrogen 2.782 N/A ASN 64.A ND2 ASP 30.A O no hydrogen 3.089 N/A VAL 65.A N TYR 62.A O no hydrogen 3.411 N/A LYS 66.A N LEU 32.A O no hydrogen 2.907 N/A MET 68.A N VAL 34.A O no hydrogen 2.918 N/A PHE 70.A N VAL 36.A O no hydrogen 2.897 N/A LYS 75.A NZ.A LEU 106.A O no hydrogen 3.063 N/A ASP 76.A N.B LEU 73.A O no hydrogen 3.124 N/A PHE 77.A N LEU 73.A O no hydrogen 3.256 N/A VAL 78.A N LEU 74.A O no hydrogen 2.800 N/A ARG 79.A N LYS 75.A O no hydrogen 3.044 N/A ARG 79.A NH1 ASP 109.A OD1 no hydrogen 2.977 N/A ARG 79.A NH2 ASP 109.A OD1 no hydrogen 2.905 N/A ALA 80.A N ASP 76.A O.A no hydrogen 3.147 N/A ALA 80.A N ASP 76.A O.B no hydrogen 2.967 N/A ASN 81.A N PHE 77.A O no hydrogen 3.208 N/A ASN 81.A N VAL 78.A O no hydrogen 3.136 N/A ASN 81.A ND2 PHE 77.A O no hydrogen 2.759 N/A ASP 82.A N ARG 79.A O no hydrogen 2.929 N/A ALA 83.A N VAL 78.A O no hydrogen 3.180 N/A ARG 84.A N VAL 4.A O no hydrogen 3.196 N/A ARG 84.A NE.B ASP 109.A O no hydrogen 3.113 N/A ARG 84.A NH1.B ASP 109.A O no hydrogen 2.874 N/A ILE 86.A N GLU 111.A O no hydrogen 2.857 N/A VAL 87.A N VAL 6.A O no hydrogen 2.718 N/A ARG 88.A N MET 113.A O no hydrogen 3.207 N/A ARG 88.A NE GLU 96.A OE1 no hydrogen 2.826 N/A ARG 88.A NH1 PRO 8.A O no hydrogen 3.005 N/A ARG 88.A NH2 GLU 96.A OE1 no hydrogen 3.241 N/A ARG 88.A NH2 GLU 96.A OE2 no hydrogen 2.771 N/A LEU 90.A N MET 115.A O no hydrogen 2.757 N/A ARG 91.A NH1 ILE 124.A O no hydrogen 2.606 N/A PHE 97.A N PHE 93.A O no hydrogen 3.075 N/A GLN 98.A N GLU 94.A O no hydrogen 3.233 N/A MET 99.A N TYR 95.A O no hydrogen 2.842 N/A ALA 100.A N GLU 96.A O no hydrogen 2.955 N/A GLY 101.A N PHE 97.A O no hydrogen 2.757 N/A MET 102.A N GLN 98.A O no hydrogen 2.774 N/A ASN 103.A N MET 99.A O no hydrogen 2.855 N/A ARG 104.A N ALA 100.A O no hydrogen 2.943 N/A ARG 104.A N GLY 101.A O no hydrogen 3.179 N/A TYR 105.A N MET 102.A O no hydrogen 3.065 N/A LEU 106.A N MET 102.A O no hydrogen 3.029 N/A LEU 107.A N ASN 103.A O no hydrogen 2.683 N/A VAL 110.A N LEU 107.A O no hydrogen 3.052 N/A GLU 111.A N ARG 84.A O no hydrogen 2.762 N/A MET 113.A N ILE 86.A O no hydrogen 2.802 N/A MET 115.A N ARG 88.A O no hydrogen 2.884 N/A THR 116.A OG1 LEU 90.A O no hydrogen 2.700 N/A SER 118.A N ASP 20.A OD2 no hydrogen 2.933 N/A SER 118.A OG ASP 20.A OD1 no hydrogen 3.244 N/A SER 118.A OG ASP 20.A OD2 no hydrogen 3.025 N/A GLN 120.A N GLN 120.A OE1 no hydrogen 2.647 N/A TYR 121.A N SER 118.A O no hydrogen 3.067 N/A GLN 122.A N ASP 119.A O no hydrogen 3.162 N/A GLN 122.A NE2 THR 116.A OG1 no hydrogen 2.984 N/A GLN 122.A NE2 PRO 117.A O no hydrogen 2.848 N/A ILE 124.A N TYR 121.A O no hydrogen 3.514 N/A ILE 128.A N SER 125.A OG no hydrogen 3.206 N/A VAL 129.A N SER 125.A O no hydrogen 2.891 N/A ARG 130.A N GLY 126.A O no hydrogen 2.955 N/A ARG 130.A NH1 ASP 12.A O no hydrogen 2.832 N/A GLU 131.A N THR 127.A O no hydrogen 3.018 N/A ILE 132.A N ILE 128.A O no hydrogen 2.894 N/A ALA 133.A N VAL 129.A O no hydrogen 2.980 N/A GLN 134.A N ARG 130.A O no hydrogen 2.814 N/A LEU 135.A N GLU 131.A O no hydrogen 3.004 N/A GLY 136.A N ALA 133.A O no hydrogen 2.993 N/A GLY 137.A N ILE 132.A O no hydrogen 2.824 N/A VAL 139.A N GLU 148.A OE1 no hydrogen 2.984 N/A SER 140.A N ASP 138.A OD2 no hydrogen 2.959 N/A SER 140.A OG ASP 138.A OD2 no hydrogen 2.989 N/A PHE 142.A N VAL 139.A O no hydrogen 2.775 N/A VAL 143.A N VAL 139.A O no hydrogen 3.049 N/A VAL 147.A N PHE 144.A O no hydrogen 2.961 N/A GLU 148.A N PHE 144.A O no hydrogen 3.108 N/A LYS 149.A N PRO 145.A O no hydrogen 3.165 N/A TRP 150.A N SER 146.A O no hydrogen 3.352 N/A TRP 150.A NE1 GLU 57.A OE1 no hydrogen 2.980 N/A TRP 150.A NE1 GLU 57.A OE2 no hydrogen 3.210 N/A LEU 151.A N VAL 147.A O no hydrogen 2.916 N/A THR 152.A N GLU 148.A O no hydrogen 2.877 N/A THR 152.A OG1 GLU 148.A O no hydrogen 2.813 N/A GLU 153.A N LYS 149.A O no hydrogen 2.993 N/A LYS 154.A N TRP 150.A O no hydrogen 2.997 N/A LYS 154.A NZ PHE 45.A O no hydrogen 3.026 N/A LYS 154.A NZ GLU 50.A OE1 no hydrogen 2.888 N/A VAL 155.A N LEU 151.A O no hydrogen 2.888 N/A ALA 156.A N THR 152.A O no hydrogen 2.943 N/A ALA 157.A N GLU 153.A O no hydrogen 2.853 N/A MET 158.A N LYS 154.A O no hydrogen 2.838 N/A ALA 159.A N VAL 155.A O no hydrogen 3.167 N/A