Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q4o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLU 6.A OE1 no hydrogen 2.802 N/A SER 3.A OG GLU 5.A OE1 no hydrogen 3.511 N/A GLU 6.A N SER 3.A OG no hydrogen 3.011 N/A LYS 7.A N SER 3.A O no hydrogen 2.923 N/A LYS 7.A NZ GLU 4.A OE1 no hydrogen 2.905 N/A GLU 8.A N GLU 4.A O no hydrogen 2.985 N/A GLY 9.A N GLU 5.A O no hydrogen 3.243 N/A LEU 10.A N GLU 6.A O no hydrogen 3.147 N/A ILE 11.A N LYS 7.A O no hydrogen 2.990 N/A GLU 12.A N GLU 8.A O no hydrogen 2.986 N/A MET 13.A N GLY 9.A O no hydrogen 2.813 N/A ARG 14.A N LEU 10.A O no hydrogen 2.893 N/A ARG 14.A NE ASP 61.A OD1 no hydrogen 2.891 N/A ARG 14.A NH1 MET 47.A O no hydrogen 2.949 N/A ARG 14.A NH2 ASP 61.A OD2 no hydrogen 2.833 N/A GLU 16.A N GLU 12.A O no hydrogen 2.879 N/A GLU 17.A N MET 13.A O no hydrogen 2.978 N/A LYS 18.A N ARG 14.A O no hydrogen 3.375 N/A LYS 18.A NZ ASP 22.A OD1 no hydrogen 2.725 N/A LYS 18.A NZ SER 67.A O no hydrogen 2.773 N/A LYS 18.A NZ VAL 70.A O no hydrogen 2.850 N/A LEU 19.A N GLU 15.A O no hydrogen 2.812 N/A ALA 20.A N GLU 16.A O no hydrogen 3.261 N/A ARG 21.A N GLU 17.A O no hydrogen 3.001 N/A ARG 21.A NE ASP 22.A OD2 no hydrogen 2.944 N/A ARG 21.A NH1 GLN 44.A OE1 no hydrogen 2.864 N/A ARG 21.A NH1 ASP 66.A OD1 no hydrogen 3.131 N/A ARG 21.A NH1 ASP 66.A OD2 no hydrogen 3.189 N/A ARG 21.A NH2 ASP 22.A OD2 no hydrogen 2.767 N/A ARG 21.A NH2 ASP 66.A O no hydrogen 2.867 N/A ARG 21.A NH2 ASP 66.A OD2 no hydrogen 3.492 N/A ASP 22.A N LYS 18.A O no hydrogen 2.817 N/A VAL 23.A N LEU 19.A O no hydrogen 2.891 N/A TYR 24.A N ALA 20.A O no hydrogen 2.894 N/A TYR 24.A OH GLY 98.A O no hydrogen 2.956 N/A LEU 25.A N ARG 21.A O no hydrogen 2.856 N/A THR 26.A N ASP 22.A O no hydrogen 2.973 N/A THR 26.A OG1 ASP 22.A O no hydrogen 2.807 N/A THR 26.A OG1 TYR 80.A OH no hydrogen 2.740 N/A LEU 27.A N VAL 23.A O no hydrogen 2.846 N/A TYR 28.A N TYR 24.A O no hydrogen 2.797 N/A ASN 29.A N LEU 25.A O no hydrogen 2.987 N/A LYS 30.A N THR 26.A O no hydrogen 3.183 N/A TRP 31.A N LEU 27.A O no hydrogen 2.938 N/A TRP 31.A NE1 GLY 87.A O no hydrogen 2.970 N/A LYS 32.A N TYR 28.A O no hydrogen 2.723 N/A PHE 36.A N LEU 33.A O no hydrogen 2.979 N/A ASN 38.A N GLN 34.A O no hydrogen 2.933 N/A ILE 39.A N ILE 35.A O no hydrogen 2.883 N/A ALA 40.A N PHE 36.A O no hydrogen 2.887 N/A GLU 41.A N LYS 37.A O no hydrogen 3.139 N/A SER 42.A N ASN 38.A O no hydrogen 3.227 N/A GLU 43.A N ILE 39.A O no hydrogen 2.902 N/A GLN 44.A N ALA 40.A O no hydrogen 2.926 N/A GLN 44.A NE2 GLN 44.A O no hydrogen 3.302 N/A GLN 44.A NE2 ASP 48.A OD1 no hydrogen 3.076 N/A THR 45.A N GLU 41.A O no hydrogen 3.094 N/A THR 45.A OG1 GLU 41.A O no hydrogen 3.336 N/A HIS 46.A N SER 42.A O no hydrogen 2.936 N/A HIS 46.A ND1 GLU 43.A OE1 no hydrogen 3.069 N/A MET 47.A N GLU 43.A O no hydrogen 2.835 N/A ASP 48.A N GLN 44.A O no hydrogen 2.934 N/A ALA 49.A N THR 45.A O no hydrogen 2.961 N/A VAL 50.A N HIS 46.A O no hydrogen 3.103 N/A LYS 51.A N MET 47.A O no hydrogen 2.924 N/A LYS 51.A NZ ASP 61.A OD2 no hydrogen 2.764 N/A TYR 52.A N ASP 48.A O no hydrogen 2.911 N/A LEU 53.A N ALA 49.A O no hydrogen 3.417 N/A LEU 54.A N VAL 50.A O no hydrogen 2.937 N/A GLU 55.A N LYS 51.A O no hydrogen 2.868 N/A LYS 56.A N TYR 52.A O no hydrogen 2.879 N/A LYS 56.A NZ ASP 120.A OD2 no hydrogen 3.450 N/A TYR 57.A N LEU 53.A O no hydrogen 3.231 N/A ASN 58.A N GLU 55.A O no hydrogen 3.117 N/A ILE 59.A N LEU 54.A O no hydrogen 2.756 N/A VAL 63.A N ASP 61.A OD1 no hydrogen 2.924 N/A LYS 64.A NZ SER 72.A OG no hydrogen 2.918 N/A SER 67.A N ASN 65.A OD1 no hydrogen 2.964 N/A SER 67.A OG ASN 65.A OD1 no hydrogen 2.684 N/A GLY 69.A N ASP 22.A OD1 no hydrogen 2.833 N/A VAL 70.A N SER 67.A O no hydrogen 3.210 N/A SER 72.A N GLU 15.A OE2 no hydrogen 2.705 N/A SER 72.A OG PRO 62.A O no hydrogen 2.593 N/A ASN 73.A N GLU 15.A OE1 no hydrogen 2.958 N/A LYS 75.A N ASN 73.A OD1 no hydrogen 2.907 N/A LYS 75.A NZ GLU 12.A OE2 no hydrogen 2.756 N/A PHE 76.A N ASN 73.A O no hydrogen 3.034 N/A GLU 78.A N PRO 74.A O no hydrogen 2.903 N/A LEU 79.A N LYS 75.A O no hydrogen 3.028 N/A TYR 80.A N PHE 76.A O no hydrogen 2.879 N/A TYR 80.A OH THR 26.A OG1 no hydrogen 2.740 N/A LYS 81.A N GLU 77.A O no hydrogen 3.053 N/A LYS 81.A NZ GLU 77.A OE1 no hydrogen 2.576 N/A LYS 82.A N GLU 78.A O no hydrogen 2.979 N/A LEU 83.A N LEU 79.A O no hydrogen 2.848 N/A VAL 84.A N TYR 80.A O no hydrogen 2.923 N/A GLU 85.A N LYS 81.A O no hydrogen 3.237 N/A LYS 86.A N LYS 82.A O no hydrogen 2.973 N/A GLY 87.A N LEU 83.A O no hydrogen 2.887 N/A ASP 88.A N VAL 84.A O no hydrogen 2.985 N/A LYS 89.A N LYS 86.A O no hydrogen 3.163 N/A LYS 89.A NZ LYS 86.A O no hydrogen 2.957 N/A SER 90.A OG ASP 93.A OD2 no hydrogen 2.743 N/A ASP 93.A N SER 90.A OG no hydrogen 2.980 N/A ALA 94.A N SER 90.A O no hydrogen 2.951 N/A LEU 95.A N GLU 91.A O no hydrogen 2.914 N/A LYS 96.A N VAL 92.A O no hydrogen 2.935 N/A LYS 96.A NZ SER 148.A OG no hydrogen 3.368 N/A LYS 96.A NZ ASN 149.A O no hydrogen 2.770 N/A VAL 97.A N ASP 93.A O no hydrogen 2.913 N/A GLY 98.A N ALA 94.A O no hydrogen 2.913 N/A ALA 99.A N LEU 95.A O no hydrogen 3.037 N/A THR 100.A N LYS 96.A O no hydrogen 2.851 N/A THR 100.A OG1 LYS 96.A O no hydrogen 2.814 N/A ILE 101.A N VAL 97.A O no hydrogen 3.042 N/A GLU 102.A N GLY 98.A O no hydrogen 3.205 N/A ASP 103.A N ALA 99.A O no hydrogen 2.836 N/A LEU 104.A N THR 100.A O no hydrogen 2.917 N/A ASP 105.A N ILE 101.A O no hydrogen 2.895 N/A ILE 106.A N GLU 102.A O no hydrogen 2.887 N/A ALA 107.A N ASP 103.A O no hydrogen 3.038 N/A ASP 108.A N LEU 104.A O no hydrogen 2.879 N/A LEU 109.A N ASP 105.A O no hydrogen 2.845 N/A GLU 110.A N ILE 106.A O no hydrogen 2.963 N/A LYS 111.A N ALA 107.A O no hydrogen 3.171 N/A TRP 112.A N ASP 108.A O no hydrogen 2.959 N/A ILE 113.A N LEU 109.A O no hydrogen 2.728 N/A ASN 114.A N GLU 110.A O no hydrogen 3.066 N/A LYS 115.A N TRP 112.A O no hydrogen 2.948 N/A THR 116.A N ILE 113.A O no hydrogen 3.197 N/A THR 116.A OG1 GLU 6.A OE2 no hydrogen 2.653 N/A ASN 118.A N THR 116.A OG1 no hydrogen 2.981 N/A LYS 122.A N ASN 118.A O no hydrogen 2.894 N/A LYS 122.A NZ ILE 113.A O no hydrogen 3.362 N/A PHE 123.A N GLU 119.A O no hydrogen 3.036 N/A VAL 124.A N ASP 120.A O no hydrogen 3.337 N/A TYR 125.A N ILE 121.A O no hydrogen 2.882 N/A GLU 126.A N LYS 122.A O no hydrogen 2.671 N/A ASN 127.A N PHE 123.A O no hydrogen 2.969 N/A LEU 128.A N VAL 124.A O no hydrogen 2.851 N/A MET 129.A N TYR 125.A O no hydrogen 2.892 N/A LYS 130.A N GLU 126.A O no hydrogen 2.892 N/A LYS 130.A NZ GLU 169.A O no hydrogen 2.588 N/A GLY 131.A N ASN 127.A O no hydrogen 2.923 N/A SER 132.A N LEU 128.A O no hydrogen 2.961 N/A SER 132.A OG GLU 102.A OE1 no hydrogen 3.128 N/A SER 132.A OG ASP 105.A OD2 no hydrogen 2.631 N/A SER 132.A OG LEU 128.A O no hydrogen 3.253 N/A ARG 133.A N MET 129.A O no hydrogen 2.888 N/A ARG 133.A NE GLU 169.A OE2 no hydrogen 2.817 N/A ARG 133.A NH2 GLU 169.A OE1 no hydrogen 2.917 N/A ASN 134.A N LYS 130.A O no hydrogen 2.988 N/A HIS 135.A N GLY 131.A O no hydrogen 2.841 N/A MET 136.A N SER 132.A O no hydrogen 2.830 N/A ARG 137.A N ARG 133.A O no hydrogen 3.027 N/A ARG 137.A NE ILE 163.A O no hydrogen 2.884 N/A ARG 137.A NE SER 166.A O no hydrogen 3.247 N/A ARG 137.A NH1 GLU 169.A OE2 no hydrogen 2.752 N/A ARG 137.A NH2 ILE 163.A O no hydrogen 3.460 N/A ARG 137.A NH2 SER 166.A OG no hydrogen 2.855 N/A ARG 137.A NH2 GLU 169.A OE2 no hydrogen 3.051 N/A ALA 138.A N ASN 134.A O no hydrogen 3.008 N/A PHE 139.A N HIS 135.A O no hydrogen 2.849 N/A VAL 140.A N MET 136.A O no hydrogen 2.880 N/A ARG 141.A N ARG 137.A O no hydrogen 2.883 N/A MET 142.A N ALA 138.A O no hydrogen 3.065 N/A LEU 143.A N PHE 139.A O no hydrogen 2.904 N/A ASN 144.A N VAL 140.A O no hydrogen 2.779 N/A ASN 144.A ND2 SER 148.A O no hydrogen 3.085 N/A ASN 145.A N ARG 141.A O no hydrogen 3.070 N/A TYR 146.A N MET 142.A O no hydrogen 3.297 N/A TYR 146.A N LEU 143.A O no hydrogen 2.922 N/A TYR 146.A OH GLU 91.A OE2 no hydrogen 2.491 N/A GLY 147.A N ASN 144.A O no hydrogen 2.883 N/A SER 148.A N LEU 143.A O no hydrogen 2.934 N/A SER 148.A OG ASN 149.A O no hydrogen 3.295 N/A ASN 149.A N SER 148.A OG no hydrogen 2.706 N/A TYR 150.A OH ASP 103.A OD2 no hydrogen 2.581 N/A GLN 153.A N ASP 103.A OD2 no hydrogen 2.765 N/A TYR 154.A N ASP 103.A OD1 no hydrogen 3.054 N/A ILE 155.A N ASP 103.A OD1 no hydrogen 2.904 N/A GLU 159.A N SER 156.A OG no hydrogen 2.900 N/A TYR 160.A N SER 156.A O no hydrogen 3.012 N/A TYR 160.A OH TYR 150.A O no hydrogen 3.424 N/A GLU 161.A N LYS 157.A O no hydrogen 2.920 N/A GLU 162.A N GLU 158.A O no hydrogen 3.003 N/A ILE 163.A N GLU 159.A O no hydrogen 2.921 N/A ILE 164.A N TYR 160.A O no hydrogen 3.033 N/A SER 165.A N GLU 161.A O no hydrogen 3.110 N/A SER 165.A OG GLU 161.A O no hydrogen 2.855 N/A SER 165.A OG GLU 162.A O no hydrogen 3.353 N/A SER 166.A N ILE 163.A O no hydrogen 3.293 N/A SER 166.A OG GLU 162.A O no hydrogen 2.826 N/A SER 166.A OG ILE 163.A O no hydrogen 2.870 N/A