Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xxi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N LEU 1.A O no hydrogen 3.051 N/A THR 5.A OG1 LEU 1.A O no hydrogen 2.893 N/A ILE 6.A N ALA 2.A O no hydrogen 2.866 N/A THR 7.A N VAL 3.A O no hydrogen 3.097 N/A THR 7.A OG1 VAL 3.A O no hydrogen 2.711 N/A GLN 8.A N ALA 4.A O no hydrogen 3.146 N/A ALA 9.A N THR 5.A O no hydrogen 3.093 N/A GLU 10.A N ILE 6.A O no hydrogen 2.821 N/A GLN 11.A N THR 7.A O no hydrogen 2.875 N/A GLN 12.A N GLN 8.A O no hydrogen 2.911 N/A GLN 12.A N ALA 9.A O no hydrogen 2.968 N/A ASP 13.A N GLU 10.A O no hydrogen 3.024 N/A ARG 14.A N ALA 9.A O no hydrogen 3.123 N/A ARG 14.A NE GLN 12.A OE1 no hydrogen 2.820 N/A ARG 14.A NH1 PHE 15.A O no hydrogen 3.113 N/A ARG 14.A NH1 GLU 20.A OE1 no hydrogen 2.909 N/A ARG 14.A NH2 GLN 12.A OE1 no hydrogen 3.200 N/A ARG 14.A NH2 GLU 20.A OE2 no hydrogen 3.076 N/A GLY 17.A N GLU 20.A OE1 no hydrogen 2.840 N/A LEU 21.A N GLY 17.A O no hydrogen 2.886 N/A ASP 22.A N ARG 18.A O no hydrogen 3.036 N/A GLU 23.A N GLY 19.A O no hydrogen 2.933 N/A LEU 24.A N GLU 20.A O no hydrogen 3.032 N/A ALA 25.A N LEU 21.A O no hydrogen 2.755 N/A SER 26.A N ASP 22.A O no hydrogen 2.938 N/A TYR 27.A N GLU 23.A O no hydrogen 3.046 N/A PHE 28.A N LEU 24.A O no hydrogen 2.959 N/A ALA 29.A N ALA 25.A O no hydrogen 2.987 N/A SER 30.A N SER 26.A O no hydrogen 2.913 N/A SER 30.A OG SER 26.A O no hydrogen 3.105 N/A SER 30.A OG TYR 27.A O no hydrogen 3.181 N/A GLY 31.A N PHE 28.A O no hydrogen 3.119 N/A LYS 33.A NZ GLU 36.A OE1 no hydrogen 2.921 N/A LYS 33.A NZ ASP 127.A OD2 no hydrogen 2.930 N/A ARG 34.A N SER 30.A O no hydrogen 2.873 N/A ARG 34.A NE SER 30.A OG no hydrogen 2.917 N/A ARG 34.A NH1 ILE 81.A O no hydrogen 2.905 N/A ARG 34.A NH1 VAL 82.A O no hydrogen 2.564 N/A ARG 34.A NH2 TYR 27.A O no hydrogen 2.820 N/A LEU 35.A N GLY 31.A O no hydrogen 2.938 N/A GLU 36.A N ALA 32.A O no hydrogen 2.979 N/A ILE 37.A N LYS 33.A O no hydrogen 2.916 N/A ALA 38.A N ARG 34.A O no hydrogen 2.941 N/A GLN 39.A N LEU 35.A O no hydrogen 2.885 N/A LEU 40.A N GLU 36.A O no hydrogen 3.161 N/A LEU 41.A N ILE 37.A O no hydrogen 2.964 N/A THR 42.A N ALA 38.A O no hydrogen 2.960 N/A THR 42.A OG1 ALA 38.A O no hydrogen 2.728 N/A GLU 43.A N GLN 39.A O no hydrogen 3.012 N/A ASN 44.A N LEU 40.A O no hydrogen 3.177 N/A ASN 44.A ND2 LEU 40.A O no hydrogen 2.984 N/A SER 45.A N THR 42.A O no hydrogen 3.079 N/A SER 45.A OG THR 42.A O no hydrogen 2.958 N/A ILE 48.A N ASN 44.A O no hydrogen 2.991 N/A VAL 49.A N SER 45.A O no hydrogen 2.820 N/A SER 50.A N GLU 46.A O no hydrogen 2.977 N/A SER 50.A OG GLU 46.A O no hydrogen 3.528 N/A SER 50.A OG ILE 47.A O no hydrogen 3.333 N/A ARG 51.A N ILE 47.A O no hydrogen 2.984 N/A ARG 51.A NE GLU 115.A OE2 no hydrogen 3.211 N/A ARG 51.A NH2 GLU 115.A OE2 no hydrogen 3.244 N/A ALA 52.A N ILE 48.A O no hydrogen 3.124 N/A ALA 53.A N VAL 49.A O no hydrogen 2.827 N/A ASN 54.A N SER 50.A O no hydrogen 2.877 N/A ARG 55.A N ARG 51.A O no hydrogen 3.200 N/A ARG 55.A NH1 ARG 55.A O no hydrogen 2.804 N/A ILE 56.A N ALA 53.A O no hydrogen 3.019 N/A PHE 57.A N ASN 54.A O no hydrogen 3.126 N/A LYS 59.A N ILE 56.A O no hydrogen 2.677 N/A LYS 59.A NZ SER 105.A OG no hydrogen 3.285 N/A ILE 60.A N PHE 57.A O no hydrogen 3.276 N/A LYS 65.A N ASN 62.A OD1 no hydrogen 3.226 N/A SER 66.A N ASN 62.A O no hydrogen 3.007 N/A SER 66.A OG ASN 62.A O no hydrogen 2.683 N/A LEU 67.A N MET 63.A O no hydrogen 2.976 N/A ARG 68.A N ALA 64.A O no hydrogen 3.007 N/A ARG 68.A NE ASP 69.A OD1 no hydrogen 2.914 N/A ARG 68.A NH2 ASP 69.A OD1 no hydrogen 2.725 N/A ASP 69.A N LYS 65.A O no hydrogen 2.746 N/A LEU 70.A N SER 66.A O no hydrogen 2.984 N/A SER 71.A N LEU 67.A O no hydrogen 3.062 N/A TRP 72.A N ARG 68.A O no hydrogen 2.793 N/A PHE 73.A N ASP 69.A O no hydrogen 2.703 N/A LEU 74.A N LEU 70.A O no hydrogen 3.082 N/A ARG 75.A N SER 71.A O no hydrogen 2.886 N/A ARG 75.A NH1 TYR 79.A OH no hydrogen 2.885 N/A TYR 76.A N TRP 72.A O no hydrogen 2.906 N/A ALA 77.A N PHE 73.A O no hydrogen 2.941 N/A THR 78.A N LEU 74.A O no hydrogen 2.943 N/A TYR 79.A N ARG 75.A O no hydrogen 2.981 N/A ALA 80.A N TYR 76.A O no hydrogen 2.958 N/A ILE 81.A N ALA 77.A O no hydrogen 2.811 N/A VAL 82.A N THR 78.A O no hydrogen 3.015 N/A ALA 83.A N TYR 79.A O no hydrogen 2.861 N/A GLY 84.A N ILE 81.A O no hydrogen 3.157 N/A ASP 85.A N ALA 80.A O no hydrogen 2.990 N/A ASN 87.A N ASP 85.A OD1 no hydrogen 3.016 N/A ILE 88.A N ASP 85.A O no hydrogen 3.029 N/A ILE 89.A N PRO 86.A O no hydrogen 2.918 N/A VAL 90.A N PRO 86.A O no hydrogen 3.309 N/A VAL 91.A N ASN 87.A O no hydrogen 2.816 N/A ASN 92.A N ILE 88.A O no hydrogen 3.145 N/A ASN 92.A ND2 ILE 88.A O no hydrogen 2.782 N/A THR 93.A N ILE 89.A O no hydrogen 2.941 N/A THR 93.A N VAL 90.A O no hydrogen 3.380 N/A THR 93.A OG1 ILE 89.A O no hydrogen 2.780 N/A THR 93.A OG1 VAL 90.A O no hydrogen 3.474 N/A ARG 94.A N VAL 91.A O no hydrogen 3.366 N/A LEU 96.A N THR 93.A O no hydrogen 2.923 N/A ILE 99.A N GLY 95.A O no hydrogen 3.380 N/A ILE 100.A N LEU 96.A O no hydrogen 2.888 N/A GLU 101.A N ARG 97.A O no hydrogen 2.783 N/A ASN 102.A N GLU 98.A O no hydrogen 3.135 N/A ALA 103.A N ILE 99.A O no hydrogen 2.940 N/A CYS 104.A N ILE 100.A O no hydrogen 2.935 N/A CYS 104.A SG ILE 100.A O no hydrogen 3.844 N/A ALA 108.A N SER 105.A OG no hydrogen 3.084 N/A THR 109.A N SER 105.A O no hydrogen 3.234 N/A THR 109.A OG1 SER 105.A O no hydrogen 2.821 N/A ILE 110.A N GLY 106.A O no hydrogen 3.206 N/A VAL 111.A N GLU 107.A O no hydrogen 3.080 N/A ALA 112.A N ALA 108.A O no hydrogen 2.798 N/A LEU 113.A N THR 109.A O no hydrogen 2.815 N/A GLN 114.A N ILE 110.A O no hydrogen 2.855 N/A GLU 115.A N VAL 111.A O no hydrogen 3.129 N/A ILE 116.A N ALA 112.A O no hydrogen 2.798 N/A LYS 117.A N LEU 113.A O no hydrogen 2.929 N/A LYS 117.A NZ SER 135.A OG no hydrogen 3.360 N/A LYS 117.A NZ ASP 139.A OD1 no hydrogen 2.720 N/A ALA 118.A N GLN 114.A O no hydrogen 2.931 N/A ALA 119.A N GLU 115.A O no hydrogen 2.738 N/A SER 120.A N ILE 116.A O no hydrogen 2.866 N/A SER 120.A OG ILE 116.A O no hydrogen 2.705 N/A LEU 121.A N LYS 117.A O no hydrogen 2.850 N/A SER 122.A N ALA 118.A O no hydrogen 3.094 N/A SER 122.A N ALA 119.A O no hydrogen 3.205 N/A SER 122.A OG ALA 119.A O no hydrogen 2.618 N/A TYR 123.A N SER 120.A O no hydrogen 3.168 N/A PHE 124.A N LEU 121.A O no hydrogen 2.968 N/A ASP 127.A N PHE 124.A O no hydrogen 2.753 N/A ALA 130.A N ASP 127.A OD1 no hydrogen 3.179 N/A ALA 131.A N ASP 127.A O no hydrogen 2.930 N/A GLU 132.A N PRO 128.A O no hydrogen 2.928 N/A ILE 133.A N GLU 129.A O no hydrogen 3.268 N/A VAL 134.A N ALA 130.A O no hydrogen 2.772 N/A SER 135.A N ALA 131.A O no hydrogen 2.769 N/A SER 135.A OG ASP 139.A OD2 no hydrogen 3.449 N/A GLN 136.A N GLU 132.A O no hydrogen 2.895 N/A TYR 137.A N ILE 133.A O no hydrogen 3.098 N/A MET 138.A N VAL 134.A O no hydrogen 2.897 N/A ASP 139.A N SER 135.A O no hydrogen 2.733 N/A VAL 140.A N GLN 136.A O no hydrogen 3.061 N/A LEU 141.A N TYR 137.A O no hydrogen 3.072 N/A ILE 142.A N MET 138.A O no hydrogen 2.937 N/A THR 143.A N ASP 139.A O no hydrogen 2.920 N/A THR 143.A OG1 ASP 139.A O no hydrogen 2.850 N/A GLU 144.A N VAL 140.A O no hydrogen 3.238 N/A PHE 145.A N ILE 142.A O no hydrogen 2.721 N/A LYS 146.A N ILE 142.A O no hydrogen 3.167 N/A