Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1aqb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG ARG 2.A O no hydrogen 4.049 N/A ARG 5.A N ASP 3.A OD1 no hydrogen 3.135 N/A ARG 5.A NE ASP 3.A OD1 no hydrogen 2.900 N/A ARG 5.A NE ASP 3.A OD2 no hydrogen 3.396 N/A ARG 5.A NH2 ASP 3.A OD2 no hydrogen 2.767 N/A VAL 6.A N GLY 127.A O no hydrogen 3.081 N/A SER 8.A N ARG 5.A O no hydrogen 2.742 N/A SER 8.A OG.A ASP 3.A OD2 no hydrogen 2.519 N/A SER 8.A OG.B ASP 3.A O no hydrogen 3.332 N/A SER 8.A OG.B ARG 5.A O no hydrogen 2.692 N/A PHE 9.A N VAL 6.A O no hydrogen 3.244 N/A LYS 12.A N ILE 106.A O no hydrogen 2.938 N/A LYS 12.A NZ THR 109.A O no hydrogen 2.910 N/A ASP 16.A N TYR 111.A OH no hydrogen 2.957 N/A LYS 17.A NZ GLY 51.A O no hydrogen 2.677 N/A LYS 17.A NZ ASP 79.A OD2 no hydrogen 2.665 N/A ARG 19.A N ASP 16.A OD1 no hydrogen 3.259 N/A PHE 20.A N ASP 16.A O no hydrogen 3.139 N/A PHE 20.A N LYS 17.A O no hydrogen 3.277 N/A SER 21.A N ALA 18.A O no hydrogen 3.076 N/A SER 21.A OG.A LYS 17.A O no hydrogen 3.235 N/A SER 21.A OG.B ALA 18.A O no hydrogen 2.518 N/A GLY 22.A N PHE 45.A O no hydrogen 3.009 N/A TRP 24.A N ALA 43.A O no hydrogen 2.872 N/A TRP 24.A NE1 PHE 20.A O no hydrogen 2.874 N/A TYR 25.A N ALA 138.A O no hydrogen 2.971 N/A ALA 26.A N ILE 41.A O no hydrogen 2.893 N/A MET 27.A N VAL 136.A O no hydrogen 2.838 N/A ALA 28.A N VAL 136.A O no hydrogen 3.453 N/A LYS 29.A N ARG 166.A O no hydrogen 2.909 N/A LYS 29.A NZ ASP 31.A OD1 no hydrogen 2.554 N/A LYS 29.A NZ ASP 31.A OD2 no hydrogen 3.557 N/A LYS 29.A NZ LEU 37.A O no hydrogen 2.893 N/A LYS 30.A N SER 134.A O no hydrogen 2.837 N/A LYS 30.A NZ ASP 31.A O no hydrogen 2.881 N/A LYS 30.A NZ SER 132.A O no hydrogen 2.840 N/A LYS 30.A NZ SER 132.A OG no hydrogen 3.118 N/A GLU 33.A N ASP 131.A OD1 no hydrogen 2.790 N/A GLN 38.A N ARG 60.A O no hydrogen 2.768 N/A ASN 40.A N THR 169.A O no hydrogen 2.815 N/A ASN 40.A ND2 ASP 39.A OD1 no hydrogen 3.022 N/A ASN 40.A ND2 ASN 171.A OD1 no hydrogen 2.929 N/A VAL 42.A N LYS 58.A O no hydrogen 3.195 N/A ALA 43.A N TRP 24.A O no hydrogen 2.895 N/A GLU 44.A N THR 56.A O no hydrogen 2.751 N/A PHE 45.A N GLY 22.A O no hydrogen 2.828 N/A SER 46.A N SER 54.A O no hydrogen 2.826 N/A SER 46.A OG.A SER 54.A OG no hydrogen 3.300 N/A ASP 48.A N HIS 52.A O no hydrogen 3.079 N/A GLY 51.A N ASP 48.A O no hydrogen 2.930 N/A HIS 52.A N ASP 48.A OD1 no hydrogen 2.933 N/A SER 54.A N SER 46.A O no hydrogen 2.949 N/A SER 54.A OG SER 46.A OG.A no hydrogen 3.300 N/A ALA 55.A N GLY 75.A O no hydrogen 2.793 N/A THR 56.A N GLU 44.A O no hydrogen 3.003 N/A ALA 57.A N MET 73.A O no hydrogen 2.970 N/A LYS 58.A N VAL 42.A O no hydrogen 2.900 N/A LYS 58.A NZ CYS 174.A O no hydrogen 3.285 N/A GLY 59.A N ALA 71.A O no hydrogen 3.149 N/A ARG 60.A N ASP 39.A O no hydrogen 2.837 N/A ARG 60.A NE ASP 39.A OD1 no hydrogen 2.932 N/A ARG 60.A NE ASP 39.A OD2 no hydrogen 3.218 N/A ARG 60.A NH1 ASP 68.A OD1 no hydrogen 3.092 N/A ARG 60.A NH2 ASP 39.A OD2 no hydrogen 2.762 N/A VAL 61.A N VAL 69.A O no hydrogen 2.788 N/A ARG 62.A NH2 ASP 68.A OD2 no hydrogen 2.811 N/A LEU 63.A N TRP 67.A O no hydrogen 2.684 N/A ASN 66.A N LEU 63.A O no hydrogen 2.659 N/A VAL 69.A N VAL 61.A O no hydrogen 2.936 N/A CYS 70.A SG TYR 173.A O no hydrogen 3.468 N/A ALA 71.A N GLY 59.A O no hydrogen 2.806 N/A MET 73.A N ALA 57.A O no hydrogen 2.832 N/A VAL 74.A N TRP 91.A O no hydrogen 2.948 N/A GLY 75.A N ALA 55.A O no hydrogen 2.836 N/A THR 76.A N LYS 89.A O no hydrogen 2.855 N/A PHE 77.A N MET 53.A O no hydrogen 3.031 N/A THR 78.A N LYS 87.A O no hydrogen 2.771 N/A THR 80.A OG1 ASP 82.A O no hydrogen 3.119 N/A THR 80.A OG1 LYS 85.A O no hydrogen 2.747 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.725 N/A ASP 82.A N THR 80.A OG1 no hydrogen 3.177 N/A ALA 84.A N ASP 82.A OD1 no hydrogen 3.051 N/A LYS 85.A N ASP 82.A O no hydrogen 2.950 N/A PHE 86.A N HIS 104.A O no hydrogen 2.912 N/A LYS 87.A N THR 78.A O no hydrogen 3.031 N/A LYS 87.A NZ ASP 103.A OD1 no hydrogen 3.382 N/A MET 88.A N ASP 102.A O no hydrogen 2.748 N/A LYS 89.A N THR 76.A O no hydrogen 2.925 N/A LYS 89.A NZ ASN 101.A OD1 no hydrogen 3.176 N/A TYR 90.A N GLY 100.A O no hydrogen 2.888 N/A TYR 90.A OH GLN 98.A OE1 no hydrogen 2.622 N/A TRP 91.A N VAL 74.A O no hydrogen 2.984 N/A VAL 93.A N ASP 72.A O no hydrogen 2.903 N/A LEU 97.A N ALA 94.A O no hydrogen 3.053 N/A LYS 99.A NZ SER 95.A O no hydrogen 3.430 N/A GLY 100.A N TYR 90.A O no hydrogen 3.028 N/A ASP 102.A N MET 88.A O no hydrogen 2.810 N/A HIS 104.A N PHE 86.A O no hydrogen 2.825 N/A TRP 105.A N TYR 118.A O no hydrogen 2.898 N/A ILE 106.A N ALA 84.A O no hydrogen 2.924 N/A ILE 107.A N VAL 116.A O no hydrogen 2.925 N/A THR 109.A OG1 TYR 114.A O no hydrogen 2.635 N/A ASP 110.A N TYR 114.A O no hydrogen 3.241 N/A TYR 111.A N THR 109.A OG1 no hydrogen 2.927 N/A THR 113.A N ASP 110.A OD1 no hydrogen 2.805 N/A THR 113.A OG1 ASP 110.A OD1 no hydrogen 3.091 N/A THR 113.A OG1 ASP 110.A OD2 no hydrogen 2.501 N/A TYR 114.A N ASP 110.A OD1 no hydrogen 2.917 N/A TYR 114.A OH ASP 108.A OD2 no hydrogen 2.649 N/A ALA 115.A N PHE 137.A O no hydrogen 3.000 N/A VAL 116.A N ASP 108.A O no hydrogen 2.791 N/A GLN 117.A N PHE 135.A O no hydrogen 2.856 N/A TYR 118.A N TRP 105.A O no hydrogen 2.913 N/A SER 119.A N TYR 133.A O no hydrogen 2.983 N/A SER 119.A OG ASP 103.A O no hydrogen 2.717 N/A CYS 120.A SG LEU 122.A O no hydrogen 3.274 N/A CYS 120.A SG ASP 131.A O no hydrogen 3.968 N/A ARG 121.A N ASP 131.A O no hydrogen 2.800 N/A ARG 121.A NE ASP 102.A OD1 no hydrogen 3.137 N/A ARG 121.A NE ASP 102.A OD2 no hydrogen 3.285 N/A ARG 121.A NH2 ASP 102.A OD2 no hydrogen 2.838 N/A LEU 122.A N ASP 131.A O no hydrogen 3.421 N/A ASN 124.A N THR 128.A O no hydrogen 2.750 N/A ASN 124.A ND2 THR 128.A OG1 no hydrogen 3.087 N/A GLY 127.A N ASN 124.A O no hydrogen 3.050 N/A THR 128.A N ASP 126.A OD1 no hydrogen 2.885 N/A THR 128.A OG1 ASP 126.A OD1 no hydrogen 2.483 N/A THR 128.A OG1 ASP 126.A OD2 no hydrogen 3.476 N/A CYS 129.A SG LEU 122.A O no hydrogen 3.508 N/A CYS 129.A SG ASP 131.A O no hydrogen 3.230 N/A ALA 130.A N LEU 122.A O no hydrogen 2.573 N/A ASP 131.A N LEU 122.A O no hydrogen 3.244 N/A TYR 133.A N SER 119.A O no hydrogen 2.973 N/A TYR 133.A OH ASP 102.A OD2 no hydrogen 2.751 N/A SER 134.A N LYS 30.A O no hydrogen 3.193 N/A SER 134.A OG GLN 117.A O no hydrogen 2.755 N/A SER 134.A OG TYR 165.A OH no hydrogen 2.551 N/A PHE 135.A N GLN 117.A OE1 no hydrogen 3.047 N/A VAL 136.A N ALA 28.A O no hydrogen 2.892 N/A PHE 137.A N ALA 115.A O no hydrogen 2.844 N/A ALA 138.A N TYR 25.A O no hydrogen 2.889 N/A ARG 139.A N THR 113.A O no hydrogen 3.065 N/A ARG 139.A NE TYR 111.A O no hydrogen 2.893 N/A ARG 139.A NH1 SER 21.A O no hydrogen 2.894 N/A ARG 139.A NH1 THR 23.A O no hydrogen 3.289 N/A ARG 139.A NH2 SER 21.A O no hydrogen 2.969 N/A ARG 139.A NH2 TYR 111.A O no hydrogen 3.053 N/A HIS 142.A N ASP 140.A OD1 no hydrogen 2.882 N/A GLY 143.A N ASP 140.A O no hydrogen 2.810 N/A VAL 148.A N SER 145.A OG no hydrogen 3.367 N/A GLN 149.A N SER 145.A O no hydrogen 2.991 N/A LYS 150.A N PRO 146.A O no hydrogen 3.047 N/A VAL 152.A N VAL 148.A O no hydrogen 2.989 N/A ARG 153.A N GLN 149.A O no hydrogen 2.908 N/A ARG 153.A NH1 LYS 150.A O no hydrogen 2.340 N/A GLN 154.A N LYS 150.A O no hydrogen 3.164 N/A GLN 154.A NE2 GLU 158.A OE2 no hydrogen 2.162 N/A ARG 155.A N ILE 151.A O no hydrogen 3.073 N/A ARG 155.A NE ASP 108.A OD2 no hydrogen 2.688 N/A ARG 155.A NH1 GLU 158.A OE1 no hydrogen 3.371 N/A ARG 155.A NH2 ASP 108.A OD2 no hydrogen 3.045 N/A GLN 156.A N VAL 152.A O no hydrogen 2.828 N/A GLU 157.A N ARG 153.A O no hydrogen 3.054 N/A GLU 158.A N GLN 154.A O no hydrogen 2.999 N/A LEU 159.A N ARG 155.A O no hydrogen 3.149 N/A LEU 159.A N GLN 156.A O no hydrogen 3.322 N/A CYS 160.A N GLU 157.A O no hydrogen 2.962 N/A LEU 161.A N GLN 156.A O no hydrogen 3.041 N/A GLN 164.A N LEU 161.A O no hydrogen 3.048 N/A TYR 165.A OH SER 134.A OG no hydrogen 2.551 N/A ARG 166.A N LYS 29.A O no hydrogen 2.882 N/A ARG 166.A NE ASP 31.A OD2 no hydrogen 3.257 N/A ARG 166.A NH2 ASP 31.A OD2 no hydrogen 3.035 N/A ILE 168.A N MET 27.A O no hydrogen 2.878 N/A HIS 170.A NE2 ALA 26.A O no hydrogen 2.779 N/A ASN 171.A N ASN 40.A OD1 no hydrogen 2.883 N/A ASP 175.A N GLY 172.A O no hydrogen 3.272 N/A