Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3aqt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N ARG 1.A O no hydrogen 3.390 N/A GLU 6.A N ALA 2.A O no hydrogen 3.231 N/A GLN 7.A N GLN 3.A O no hydrogen 3.102 N/A THR 8.A N LYS 4.A O no hydrogen 2.898 N/A THR 8.A OG1 LYS 4.A O no hydrogen 2.942 N/A ARG 9.A N ARG 5.A O no hydrogen 3.138 N/A ARG 9.A NE TYR 46.A O no hydrogen 3.290 N/A ALA 10.A N GLU 6.A O no hydrogen 3.174 N/A ARG 11.A N GLN 7.A O no hydrogen 2.920 N/A LEU 12.A N THR 8.A O no hydrogen 2.771 N/A ILE 13.A N ARG 9.A O no hydrogen 2.962 N/A THR 14.A N ALA 10.A O no hydrogen 3.001 N/A THR 14.A OG1 ALA 10.A O no hydrogen 3.134 N/A SER 15.A N ARG 11.A O no hydrogen 2.865 N/A SER 15.A OG ILE 32.A O no hydrogen 2.677 N/A ALA 16.A N LEU 12.A O no hydrogen 2.892 N/A ARG 17.A N ILE 13.A O no hydrogen 3.029 N/A ARG 17.A NH1 ASP 60.A OD2 no hydrogen 3.166 N/A THR 18.A N THR 14.A O no hydrogen 3.073 N/A THR 18.A OG1 THR 14.A O no hydrogen 2.915 N/A LEU 19.A N SER 15.A O no hydrogen 2.984 N/A GLU 21.A N LEU 19.A O no hydrogen 3.230 N/A ARG 22.A N LEU 19.A O no hydrogen 2.947 N/A ASN 26.A N GLY 23.A O no hydrogen 3.085 N/A ASN 26.A ND2 ARG 22.A O no hydrogen 2.664 N/A GLY 28.A N GLU 31.A OE2 no hydrogen 2.831 N/A GLU 31.A N GLU 31.A OE1 no hydrogen 2.547 N/A ILE 32.A N GLY 28.A O no hydrogen 3.042 N/A THR 33.A N ILE 29.A O no hydrogen 2.850 N/A THR 33.A OG1 ILE 29.A O no hydrogen 2.776 N/A THR 33.A OG1 ALA 30.A O no hydrogen 2.902 N/A GLU 34.A N ALA 30.A O no hydrogen 3.107 N/A GLY 35.A N GLU 31.A O no hydrogen 3.041 N/A ALA 36.A N ILE 32.A O no hydrogen 3.139 N/A ASN 37.A N GLU 34.A O no hydrogen 2.890 N/A ILE 38.A N THR 33.A O no hydrogen 2.966 N/A THR 42.A N GLY 39.A O no hydrogen 3.033 N/A THR 42.A OG1 GLY 39.A O no hydrogen 2.713 N/A PHE 43.A N THR 40.A O no hydrogen 3.151 N/A ASN 45.A N THR 42.A O no hydrogen 2.962 N/A TYR 46.A N PHE 43.A O no hydrogen 2.938 N/A PHE 47.A N PHE 43.A O no hydrogen 3.298 N/A ARG 50.A NE VAL 27.A O no hydrogen 3.177 N/A ARG 50.A NH2 VAL 27.A O no hydrogen 2.945 N/A GLU 51.A N ASP 49.A OD2 no hydrogen 2.906 N/A GLN 52.A N ASP 49.A O no hydrogen 3.265 N/A LEU 54.A N ARG 50.A O no hydrogen 3.023 N/A GLN 55.A N GLU 51.A O no hydrogen 3.024 N/A GLN 55.A NE2 GLU 51.A O no hydrogen 3.646 N/A ALA 56.A N GLN 52.A O no hydrogen 3.094 N/A VAL 57.A N LEU 53.A O no hydrogen 2.939 N/A ALA 58.A N LEU 54.A O no hydrogen 2.992 N/A GLU 59.A N GLN 55.A O no hydrogen 2.788 N/A ASP 60.A N ALA 56.A O no hydrogen 2.939 N/A ALA 61.A N VAL 57.A O no hydrogen 3.034 N/A PHE 62.A N ALA 58.A O no hydrogen 2.775 N/A GLU 63.A N GLU 59.A O no hydrogen 2.856 N/A SER 64.A N ASP 60.A O no hydrogen 3.176 N/A SER 64.A OG ASP 60.A O no hydrogen 2.858 N/A VAL 65.A N ALA 61.A O no hydrogen 3.469 N/A GLY 66.A N PHE 62.A O no hydrogen 2.883 N/A ILE 67.A N GLU 63.A O no hydrogen 2.853 N/A ALA 68.A N SER 64.A O no hydrogen 3.103 N/A LEU 69.A N VAL 65.A O no hydrogen 2.819 N/A ASP 70.A N GLY 66.A O no hydrogen 2.915 N/A GLN 71.A N ALA 68.A O no hydrogen 3.085 N/A VAL 72.A N LEU 69.A O no hydrogen 2.933 N/A THR 74.A OG1 ASP 70.A O no hydrogen 2.622 N/A LYS 75.A N VAL 72.A O no hydrogen 2.661 N/A LYS 75.A NZ GLN 71.A O no hydrogen 3.089 N/A LEU 76.A N LEU 73.A O no hydrogen 3.020 N/A ALA 80.A N ASP 78.A OD1 no hydrogen 2.957 N/A VAL 82.A N ASP 78.A O no hydrogen 3.116 N/A PHE 83.A N PRO 79.A O no hydrogen 3.167 N/A ALA 84.A N ALA 80.A O no hydrogen 2.939 N/A GLY 85.A N GLU 81.A O no hydrogen 2.866 N/A SER 86.A N VAL 82.A O no hydrogen 3.105 N/A SER 86.A OG VAL 82.A O no hydrogen 2.644 N/A LEU 87.A N PHE 83.A O no hydrogen 3.061 N/A ARG 88.A N ALA 84.A O no hydrogen 2.941 N/A ARG 88.A NE ASP 161.A OD2 no hydrogen 2.733 N/A ARG 88.A NH1 ARG 183.A O no hydrogen 2.970 N/A ARG 88.A NH2 ASP 161.A OD2 no hydrogen 3.451 N/A HIS 89.A N GLY 85.A O no hydrogen 2.994 N/A LEU 90.A N SER 86.A O no hydrogen 3.173 N/A VAL 91.A N LEU 87.A O no hydrogen 2.906 N/A ARG 92.A N ARG 88.A O no hydrogen 2.847 N/A ARG 92.A NE ASP 161.A OD2 no hydrogen 3.268 N/A HIS 93.A N HIS 89.A O no hydrogen 2.940 N/A SER 94.A N LEU 90.A O no hydrogen 3.030 N/A SER 94.A OG LEU 90.A O no hydrogen 2.804 N/A LEU 95.A N VAL 91.A O no hydrogen 3.088 N/A LEU 95.A N ARG 92.A O no hydrogen 3.281 N/A GLU 96.A N ARG 92.A O no hydrogen 3.019 N/A GLU 96.A N HIS 93.A O no hydrogen 3.236 N/A ASP 97.A N HIS 93.A O no hydrogen 2.845 N/A GLY 101.A N ASP 97.A O no hydrogen 3.178 N/A GLY 102.A N ARG 98.A O no hydrogen 3.324 N/A PHE 103.A N ILE 99.A O no hydrogen 3.320 N/A PHE 103.A N TRP 100.A O no hydrogen 2.797 N/A PHE 104.A N TRP 100.A O no hydrogen 3.368 N/A ILE 105.A N GLY 101.A O no hydrogen 3.162 N/A HIS 110.A NE2 THR 143.A O no hydrogen 3.042 N/A VAL 112.A N ALA 108.A O no hydrogen 3.091 N/A LEU 113.A N ALA 109.A O no hydrogen 2.887 N/A ARG 114.A NH1 GLU 59.A OE2 no hydrogen 2.777 N/A ARG 114.A NH2 GLN 55.A OE1 no hydrogen 3.525 N/A ILE 115.A N VAL 112.A O no hydrogen 3.214 N/A LEU 116.A N LEU 113.A O no hydrogen 2.807 N/A GLY 117.A N LEU 113.A O no hydrogen 3.014 N/A ARG 119.A NE ASP 70.A OD2 no hydrogen 2.563 N/A ARG 119.A NH1 ILE 115.A O no hydrogen 3.015 N/A ARG 119.A NH2 ASP 70.A OD2 no hydrogen 3.414 N/A ALA 120.A N LEU 116.A O no hydrogen 2.878 N/A ARG 121.A N GLY 117.A O no hydrogen 2.883 N/A ARG 121.A NE ASP 139.A OD1 no hydrogen 2.758 N/A ARG 122.A N PRO 118.A O no hydrogen 3.103 N/A ARG 122.A NE ASP 123.A OD1 no hydrogen 2.792 N/A ARG 122.A NH1 ASP 70.A OD1 no hydrogen 2.926 N/A ARG 122.A NH2 ASP 70.A OD1 no hydrogen 2.820 N/A ARG 122.A NH2 ASP 123.A OD1 no hydrogen 3.013 N/A ARG 122.A NH2 ASP 123.A OD2 no hydrogen 3.349 N/A ASP 123.A N ARG 119.A O no hydrogen 3.113 N/A LEU 124.A N ALA 120.A O no hydrogen 2.889 N/A LEU 125.A N ARG 121.A O no hydrogen 2.847 N/A HIS 126.A N ARG 122.A O no hydrogen 2.999 N/A GLY 127.A N ASP 123.A O no hydrogen 3.127 N/A LEU 128.A N LEU 124.A O no hydrogen 2.869 N/A LEU 128.A N LEU 125.A O no hydrogen 2.914 N/A GLU 129.A N LEU 125.A O no hydrogen 2.798 N/A THR 130.A N HIS 126.A O no hydrogen 2.944 N/A GLY 131.A N LEU 128.A O no hydrogen 3.081 N/A ARG 132.A N GLY 127.A O no hydrogen 2.856 N/A ARG 132.A NE ASP 78.A OD1 no hydrogen 2.819 N/A ARG 132.A NH1 GLU 176.A OE2 no hydrogen 2.732 N/A ARG 132.A NH2 ASP 78.A OD1 no hydrogen 3.376 N/A ARG 132.A NH2 ASP 78.A OD2 no hydrogen 2.751 N/A ARG 132.A NH2 GLU 176.A OE2 no hydrogen 3.426 N/A PHE 133.A N GLY 127.A O no hydrogen 2.999 N/A THR 134.A N VAL 170.A O no hydrogen 2.752 N/A LEU 140.A N ASP 137.A OD1 no hydrogen 2.871 N/A ALA 141.A N ASP 137.A O no hydrogen 3.020 N/A THR 142.A N LEU 138.A O no hydrogen 3.093 N/A THR 143.A N ASP 139.A O no hydrogen 2.967 N/A CYS 144.A N LEU 140.A O no hydrogen 2.914 N/A CYS 144.A SG LEU 140.A O no hydrogen 3.256 N/A THR 145.A N ALA 141.A O no hydrogen 3.068 N/A THR 145.A OG1 ALA 141.A O no hydrogen 2.716 N/A PHE 146.A N THR 142.A O no hydrogen 3.479 N/A GLY 147.A N THR 143.A O no hydrogen 3.082 N/A SER 148.A N CYS 144.A O no hydrogen 2.834 N/A SER 148.A OG CYS 144.A O no hydrogen 3.162 N/A LEU 149.A N THR 145.A O no hydrogen 2.778 N/A ILE 150.A N PHE 146.A O no hydrogen 3.026 N/A ALA 151.A N GLY 147.A O no hydrogen 3.268 N/A ALA 152.A N SER 148.A O no hydrogen 2.750 N/A ILE 153.A N LEU 149.A O no hydrogen 2.853 N/A GLN 154.A N ILE 150.A O no hydrogen 2.897 N/A LEU 156.A N ILE 153.A O no hydrogen 2.903 N/A SER 157.A OG GLN 154.A O no hydrogen 3.390 N/A GLN 162.A N ASP 159.A O no hydrogen 3.009 N/A ILE 163.A N ASP 159.A O no hydrogen 3.401 N/A PHE 164.A N LYS 160.A O no hydrogen 3.010 N/A ALA 165.A N ASP 161.A O no hydrogen 3.002 N/A ALA 166.A N GLN 162.A O no hydrogen 2.902 N/A ALA 167.A N ILE 163.A O no hydrogen 3.167 N/A ARG 169.A N ALA 166.A O no hydrogen 2.846 N/A GLY 171.A N ARG 169.A O no hydrogen 3.059 N/A VAL 172.A N LEU 168.A O no hydrogen 3.117 N/A ALA 177.A N GLN 173.A O no hydrogen 2.955 N/A ILE 180.A N GLU 176.A O no hydrogen 3.197 N/A ALA 181.A N ALA 177.A O no hydrogen 3.099 N/A SER 182.A N GLU 179.A O no hydrogen 2.917 N/A SER 182.A OG ARG 178.A O no hydrogen 2.973 N/A SER 182.A OG GLU 179.A O no hydrogen 2.776 N/A ARG 183.A NE GLU 81.A OE1 no hydrogen 3.336 N/A ARG 183.A NH1 GLU 179.A OE1 no hydrogen 2.763 N/A ARG 183.A NH2 ASP 78.A OD2 no hydrogen 2.980 N/A ARG 183.A NH2 GLU 81.A OE1 no hydrogen 3.155 N/A SER 189.A N GLU 187.A OE2 no hydrogen 3.133 N/A