Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mdu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 4.A NE2 ASP 25.A OD1 no hydrogen 2.928 N/A GLU 6.A N HIS 4.A ND1 no hydrogen 3.053 N/A LEU 8.A N HIS 4.A O no hydrogen 3.337 N/A LYS 9.A N PRO 5.A O no hydrogen 3.384 N/A ALA 10.A N PHE 7.A O no hydrogen 3.205 N/A GLY 11.A N GLN 17.A OE1 no hydrogen 2.587 N/A GLY 15.A N THR 48.A O no hydrogen 2.868 N/A GLN 17.A N LEU 46.A O no hydrogen 2.936 N/A GLN 17.A NE2 LYS 9.A O no hydrogen 2.706 N/A ILE 18.A N TYR 34.A OH no hydrogen 3.283 N/A TRP 19.A N VAL 44.A O no hydrogen 2.865 N/A TRP 19.A NE1 GLU 6.A OE1 no hydrogen 2.742 N/A ARG 20.A N VAL 27.A O no hydrogen 2.834 N/A ARG 20.A NE GLU 22.A OE1 no hydrogen 3.350 N/A ARG 20.A NH1 ASP 41.A OD1 no hydrogen 2.856 N/A ARG 20.A NH2 GLU 22.A OE1 no hydrogen 2.768 N/A VAL 21.A N ALA 42.A O no hydrogen 2.861 N/A GLU 22.A N ASP 25.A O no hydrogen 2.687 N/A ASP 25.A N GLU 22.A O no hydrogen 2.926 N/A VAL 27.A N ARG 20.A O no hydrogen 2.895 N/A VAL 29.A N ILE 18.A O no hydrogen 2.855 N/A LEU 33.A N PRO 30.A O no hydrogen 2.492 N/A TYR 34.A N THR 31.A O no hydrogen 3.283 N/A TYR 34.A OH LEU 16.A O no hydrogen 3.346 N/A ASP 36.A N LEU 33.A O no hydrogen 3.172 N/A PHE 37.A N LYS 114.A O no hydrogen 2.735 N/A PHE 38.A N TYR 43.A OH no hydrogen 2.719 N/A THR 39.A N LYS 116.A O no hydrogen 2.840 N/A GLY 40.A N GLY 118.A O no hydrogen 2.983 N/A ASP 41.A N PHE 38.A O no hydrogen 3.113 N/A TYR 43.A N TRP 63.A O no hydrogen 2.870 N/A VAL 44.A N TRP 19.A O no hydrogen 2.879 N/A ILE 45.A N HIS 61.A O no hydrogen 2.557 N/A LEU 46.A N GLN 17.A O no hydrogen 2.812 N/A LYS 47.A N ASP 59.A O no hydrogen 2.879 N/A THR 48.A N GLY 15.A O no hydrogen 2.923 N/A VAL 49.A N GLN 57.A O no hydrogen 2.993 N/A LEU 51.A N ASN 55.A O no hydrogen 2.767 N/A GLY 54.A N LEU 51.A O no hydrogen 2.973 N/A ASN 55.A N ASN 53.A OD1 no hydrogen 2.869 N/A GLN 57.A N VAL 49.A O no hydrogen 2.873 N/A TYR 58.A OH GLY 11.A O no hydrogen 2.741 N/A ASP 59.A N LYS 47.A O no hydrogen 3.060 N/A LEU 60.A N VAL 92.A O no hydrogen 2.784 N/A HIS 61.A N ILE 45.A O no hydrogen 2.693 N/A HIS 61.A ND1 GLU 96.A OE2 no hydrogen 2.809 N/A HIS 61.A NE2 TYR 108.A OH no hydrogen 3.056 N/A TYR 62.A N HIS 94.A O no hydrogen 3.071 N/A TRP 63.A N TYR 43.A O no hydrogen 2.800 N/A TRP 63.A NE1 GLU 101.A OE2 no hydrogen 3.046 N/A LEU 64.A N GLU 96.A O no hydrogen 2.917 N/A GLY 65.A N ASP 41.A O no hydrogen 3.136 N/A ASN 66.A N GLN 98.A OE1 no hydrogen 3.280 N/A GLU 67.A N THR 39.A O no hydrogen 2.891 N/A CYS 68.A N GLY 65.A O no hydrogen 3.144 N/A CYS 68.A SG GLY 65.A O no hydrogen 3.358 N/A SER 69.A N GLU 72.A OE1 no hydrogen 3.066 N/A SER 69.A OG ASP 71.A OD1 no hydrogen 2.289 N/A GLU 72.A N SER 69.A O no hydrogen 2.743 N/A SER 73.A N SER 69.A O no hydrogen 3.239 N/A SER 73.A OG SER 69.A O no hydrogen 3.435 N/A SER 73.A OG GLN 70.A O no hydrogen 3.011 N/A GLY 74.A N GLN 70.A O no hydrogen 2.796 N/A ALA 75.A N ASP 71.A O no hydrogen 3.010 N/A ALA 76.A N GLU 72.A O no hydrogen 2.870 N/A ALA 77.A N SER 73.A O no hydrogen 3.141 N/A ILE 78.A N GLY 74.A O no hydrogen 2.940 N/A PHE 79.A N ALA 75.A O no hydrogen 2.682 N/A THR 80.A N ALA 76.A O no hydrogen 3.091 N/A THR 80.A OG1 ALA 76.A O no hydrogen 2.879 N/A VAL 81.A N ALA 77.A O no hydrogen 3.313 N/A GLN 82.A N ILE 78.A O no hydrogen 3.055 N/A LEU 83.A N PHE 79.A O no hydrogen 2.832 N/A ASP 84.A N THR 80.A O no hydrogen 2.910 N/A ASP 85.A N VAL 81.A O no hydrogen 2.795 N/A TYR 86.A N GLN 82.A O no hydrogen 2.842 N/A LEU 87.A N LEU 83.A O no hydrogen 3.025 N/A ASN 88.A N ASP 85.A O no hydrogen 2.901 N/A GLY 89.A N ASP 84.A O no hydrogen 2.581 N/A ARG 90.A N LEU 87.A O no hydrogen 3.050 N/A ARG 90.A NH1 LEU 87.A O no hydrogen 3.260 N/A ARG 90.A NH2 LEU 56.A O no hydrogen 3.421 N/A ALA 91.A N ASP 84.A OD1 no hydrogen 3.254 N/A VAL 92.A N TYR 58.A O no hydrogen 3.254 N/A GLN 93.A NE2 ASP 84.A OD2 no hydrogen 2.951 N/A HIS 94.A N LEU 60.A O no hydrogen 2.709 N/A HIS 94.A NE2 ASP 59.A OD1 no hydrogen 2.938 N/A GLU 96.A N TYR 62.A O no hydrogen 2.913 N/A GLN 98.A N LEU 64.A O no hydrogen 3.273 N/A GLY 99.A N GLU 101.A OE2 no hydrogen 3.418 N/A PHE 100.A N VAL 97.A O no hydrogen 2.880 N/A GLU 101.A N GLU 101.A OE1 no hydrogen 2.547 N/A SER 102.A N GLU 96.A OE1 no hydrogen 2.814 N/A SER 102.A OG GLU 96.A OE1 no hydrogen 3.557 N/A SER 102.A OG GLU 96.A OE2 no hydrogen 2.782 N/A PHE 105.A N SER 102.A OG no hydrogen 3.228 N/A LEU 106.A N SER 102.A O no hydrogen 2.937 N/A GLY 107.A N ALA 103.A O no hydrogen 2.719 N/A TYR 108.A N PHE 105.A O no hydrogen 2.928 N/A TYR 108.A OH HIS 61.A NE2 no hydrogen 3.056 N/A PHE 109.A N LEU 106.A O no hydrogen 3.271 N/A GLY 112.A N PHE 109.A O no hydrogen 2.862 N/A LYS 114.A N GLY 35.A O no hydrogen 2.879 N/A TYR 115.A OH GLU 101.A OE2 no hydrogen 2.583 N/A LYS 116.A N PHE 37.A O no hydrogen 2.862 N/A LYS 116.A NZ ASP 36.A OD2 no hydrogen 3.404 N/A VAL 120.A N ASP 41.A OD1 no hydrogen 2.883 N/A SER 122.A OG ASP 71.A OD1 no hydrogen 3.075 N/A GLY 123.A N ASP 71.A OD2 no hydrogen 3.144 N/A PHE 124.A N SER 122.A OG no hydrogen 3.055 N/A