Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kqn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ARG 35.A O no hydrogen 3.147 N/A VAL 4.A N THR 37.A O no hydrogen 2.881 N/A VAL 5.A N LYS 107.A O no hydrogen 2.974 N/A LEU 6.A N LYS 40.A O no hydrogen 2.967 N/A LEU 7.A N LYS 109.A O no hydrogen 2.834 N/A ALA 8.A N ILE 42.A O no hydrogen 2.857 N/A CYS 9.A SG GLU 81.A OE2 no hydrogen 3.604 N/A GLY 10.A N SER 44.A O no hydrogen 3.393 N/A ASN 13.A ND2 GLY 54.A O no hydrogen 2.736 N/A THR 16.A N HIS 19.A ND1 no hydrogen 2.953 N/A THR 16.A OG1 ILE 178.A O no hydrogen 3.150 N/A ASN 17.A N LEU 196.A O no hydrogen 2.861 N/A MET 18.A N THR 16.A OG1 no hydrogen 3.035 N/A LEU 20.A N THR 16.A O no hydrogen 3.431 N/A ARG 21.A N ASN 17.A O no hydrogen 2.847 N/A LEU 22.A N MET 18.A O no hydrogen 3.001 N/A PHE 23.A N LEU 20.A O no hydrogen 3.044 N/A GLU 24.A N LEU 20.A O no hydrogen 3.223 N/A LEU 25.A N ARG 21.A O no hydrogen 2.778 N/A ALA 26.A N LEU 22.A O no hydrogen 3.120 N/A LYS 27.A N PHE 23.A O no hydrogen 2.852 N/A ASP 28.A N GLU 24.A O no hydrogen 2.952 N/A TYR 29.A N LEU 25.A O no hydrogen 2.815 N/A MET 30.A N ALA 26.A O no hydrogen 2.974 N/A ASN 31.A N LYS 27.A O no hydrogen 2.900 N/A GLY 32.A N ASP 28.A O no hydrogen 2.793 N/A THR 33.A N MET 30.A O no hydrogen 3.336 N/A THR 33.A OG1 MET 30.A O no hydrogen 2.851 N/A GLY 34.A N ASN 31.A O no hydrogen 3.190 N/A ARG 35.A N THR 33.A OG1 no hydrogen 3.075 N/A THR 37.A N THR 2.A O no hydrogen 2.981 N/A VAL 38.A N ASN 31.A OD1 no hydrogen 2.956 N/A VAL 39.A N VAL 4.A O no hydrogen 2.827 N/A GLY 41.A N TRP 74.A O no hydrogen 2.930 N/A ILE 42.A N LEU 6.A O no hydrogen 2.759 N/A ILE 43.A N GLU 76.A O no hydrogen 2.778 N/A SER 44.A N ALA 8.A O no hydrogen 3.076 N/A SER 44.A OG GLU 81.A OE2 no hydrogen 2.624 N/A VAL 46.A N GLY 10.A O no hydrogen 2.994 N/A TYR 50.A N GLY 47.A O no hydrogen 3.174 N/A LYS 51.A N ASP 48.A O no hydrogen 3.023 N/A LYS 53.A NZ GLU 216.A O no hydrogen 3.454 N/A GLY 54.A N ARG 218.A O no hydrogen 2.828 N/A LEU 55.A N LYS 52.A O no hydrogen 3.111 N/A ILE 56.A N ASN 13.A OD1 no hydrogen 3.414 N/A ALA 58.A N ASP 48.A OD2 no hydrogen 3.033 N/A HIS 60.A N PRO 57.A O no hydrogen 3.216 N/A HIS 60.A ND1 TYR 204.A OH no hydrogen 2.634 N/A ARG 61.A N PRO 57.A O no hydrogen 3.390 N/A ARG 61.A NE ILE 56.A O no hydrogen 2.821 N/A ARG 61.A NH1 SER 11.A O no hydrogen 2.991 N/A ARG 61.A NH1 VAL 46.A O no hydrogen 2.877 N/A ARG 61.A NH2 VAL 46.A O no hydrogen 2.726 N/A ARG 61.A NH2 ASP 48.A OD1 no hydrogen 3.201 N/A ARG 61.A NH2 ILE 56.A O no hydrogen 3.566 N/A VAL 62.A N ALA 58.A O no hydrogen 2.817 N/A ILE 63.A N TYR 59.A O no hydrogen 3.003 N/A MET 64.A N HIS 60.A O no hydrogen 2.810 N/A ALA 65.A N ARG 61.A O no hydrogen 3.189 N/A GLU 66.A N VAL 62.A O no hydrogen 3.065 N/A LEU 67.A N ILE 63.A O no hydrogen 2.831 N/A ALA 68.A N MET 64.A O no hydrogen 2.754 N/A THR 69.A N ALA 65.A O no hydrogen 2.962 N/A THR 69.A N GLU 66.A O no hydrogen 3.278 N/A THR 69.A OG1 ALA 65.A O no hydrogen 2.746 N/A LYS 70.A N LEU 67.A O no hydrogen 3.193 N/A SER 72.A N THR 69.A O no hydrogen 2.961 N/A TRP 74.A N SER 72.A OG no hydrogen 3.116 N/A TRP 74.A NE1 GLU 24.A OE2 no hydrogen 3.127 N/A VAL 75.A N SER 72.A OG no hydrogen 2.832 N/A GLU 76.A N GLY 41.A O no hydrogen 2.838 N/A ASP 78.A N ILE 43.A O no hydrogen 2.800 N/A TRP 80.A N ASP 78.A OD2 no hydrogen 2.783 N/A SER 82.A OG THR 79.A O no hydrogen 2.628 N/A LEU 83.A N THR 79.A O no hydrogen 3.085 N/A LEU 83.A N TRP 80.A O no hydrogen 3.298 N/A GLN 84.A N GLU 81.A O no hydrogen 3.340 N/A GLN 84.A NE2 TRP 80.A O no hydrogen 3.135 N/A GLU 89.A N GLU 89.A OE1 no hydrogen 2.872 N/A LYS 92.A N GLU 89.A O no hydrogen 2.630 N/A LYS 92.A NZ GLU 89.A OE1 no hydrogen 2.782 N/A VAL 93.A N GLU 89.A O no hydrogen 3.075 N/A LEU 94.A N THR 90.A O no hydrogen 2.753 N/A ARG 95.A N LEU 91.A O no hydrogen 2.867 N/A ARG 95.A NH2 GLN 133.A OE1 no hydrogen 3.252 N/A HIS 96.A N LYS 92.A O no hydrogen 2.758 N/A HIS 97.A N VAL 93.A O no hydrogen 2.979 N/A GLN 98.A N LEU 94.A O no hydrogen 2.924 N/A GLN 98.A NE2 GLN 98.A O no hydrogen 3.507 N/A GLN 98.A NE2 PRO 106.A O no hydrogen 3.068 N/A GLU 99.A N ARG 95.A O no hydrogen 2.762 N/A LYS 100.A N HIS 96.A O no hydrogen 3.020 N/A LEU 101.A N HIS 97.A O no hydrogen 2.927 N/A GLU 102.A N GLN 98.A O no hydrogen 3.064 N/A ALA 103.A N LYS 100.A O no hydrogen 2.924 N/A LYS 107.A N GLU 3.A O no hydrogen 3.115 N/A VAL 108.A N GLN 98.A OE1 no hydrogen 2.855 N/A LYS 109.A N VAL 5.A O no hydrogen 2.885 N/A LYS 109.A NZ TYR 138.A O no hydrogen 2.837 N/A LEU 110.A N GLY 139.A O no hydrogen 2.925 N/A LEU 111.A N LEU 7.A O no hydrogen 2.793 N/A CYS 112.A N ILE 141.A O no hydrogen 3.000 N/A CYS 112.A SG GLY 113.A O no hydrogen 3.635 N/A LEU 116.A N GLY 113.A O no hydrogen 3.194 N/A LEU 117.A N GLY 113.A O no hydrogen 3.311 N/A GLU 118.A N ALA 114.A O no hydrogen 2.936 N/A SER 119.A N ASP 115.A O no hydrogen 3.044 N/A SER 119.A N LEU 116.A O no hydrogen 3.108 N/A SER 119.A OG LEU 116.A O no hydrogen 2.655 N/A PHE 120.A N LEU 117.A O no hydrogen 3.057 N/A ALA 121.A N GLU 118.A O no hydrogen 3.083 N/A VAL 122.A N SER 119.A O no hydrogen 2.828 N/A LEU 125.A N VAL 122.A O no hydrogen 3.162 N/A TRP 126.A NE1 SER 119.A OG no hydrogen 2.851 N/A SER 128.A OG GLU 129.A OE2 no hydrogen 2.986 N/A ASP 130.A N LYS 127.A O no hydrogen 2.860 N/A ILE 131.A N LYS 127.A O no hydrogen 3.168 N/A THR 132.A N SER 128.A O no hydrogen 3.082 N/A THR 132.A OG1 SER 128.A O no hydrogen 3.259 N/A GLN 133.A N GLU 129.A O no hydrogen 2.902 N/A GLN 133.A NE2 GLU 129.A O no hydrogen 3.664 N/A ILE 134.A N ASP 130.A O no hydrogen 2.895 N/A VAL 135.A N ILE 131.A O no hydrogen 3.095 N/A ALA 136.A N THR 132.A O no hydrogen 2.957 N/A ASN 137.A N GLN 133.A O no hydrogen 2.696 N/A TYR 138.A N ILE 134.A O no hydrogen 2.945 N/A GLY 139.A N ILE 134.A O no hydrogen 2.827 N/A LEU 140.A N ASN 166.A O no hydrogen 3.098 N/A ILE 141.A N LEU 110.A O no hydrogen 2.767 N/A CYS 142.A N HIS 168.A O no hydrogen 2.811 N/A VAL 143.A N CYS 112.A O no hydrogen 2.858 N/A THR 144.A N VAL 170.A O no hydrogen 2.931 N/A ALA 146.A N THR 144.A OG1 no hydrogen 2.803 N/A ALA 150.A N ALA 146.A O no hydrogen 3.287 N/A GLN 151.A N GLY 147.A O no hydrogen 2.952 N/A LYS 152.A N ASN 148.A O no hydrogen 2.639 N/A PHE 153.A N ASP 149.A O no hydrogen 2.847 N/A ILE 154.A N ALA 150.A O no hydrogen 3.082 N/A TYR 155.A N GLN 151.A O no hydrogen 2.776 N/A GLU 156.A N LYS 152.A O no hydrogen 2.759 N/A SER 157.A N ILE 154.A O no hydrogen 3.124 N/A LEU 160.A N SER 157.A OG no hydrogen 3.180 N/A TRP 161.A N SER 157.A O no hydrogen 2.751 N/A LYS 162.A N ASP 158.A O no hydrogen 2.933 N/A HIS 163.A N VAL 159.A O no hydrogen 3.195 N/A ARG 164.A N TRP 161.A O no hydrogen 3.037 N/A ARG 164.A NH1 TRP 161.A O no hydrogen 3.109 N/A ASN 166.A N HIS 163.A O no hydrogen 2.644 N/A ILE 167.A N ARG 164.A O no hydrogen 3.194 N/A HIS 168.A N LEU 140.A O no hydrogen 2.878 N/A VAL 170.A N CYS 142.A O no hydrogen 2.702 N/A GLU 172.A N THR 144.A O no hydrogen 2.991 N/A ASN 176.A N GLU 172.A OE2 no hydrogen 2.901 N/A SER 180.A OG PRO 14.A O no hydrogen 2.795 N/A LYS 182.A N SER 179.A OG no hydrogen 2.966 N/A LYS 182.A NZ ASP 177.A OD2 no hydrogen 2.901 N/A ILE 183.A N SER 179.A O no hydrogen 3.061 N/A ARG 184.A N SER 180.A O no hydrogen 2.875 N/A ARG 184.A NE GLU 216.A OE1 no hydrogen 2.857 N/A ARG 184.A NE GLU 216.A OE2 no hydrogen 3.441 N/A ARG 184.A NH1 ASN 13.A O no hydrogen 2.839 N/A ARG 184.A NH2 GLU 216.A OE2 no hydrogen 2.933 N/A ARG 185.A N THR 181.A O no hydrogen 3.016 N/A ALA 186.A N LYS 182.A O no hydrogen 3.008 N/A LEU 187.A N ILE 183.A O no hydrogen 2.996 N/A ARG 188.A N ARG 184.A O no hydrogen 2.863 N/A ARG 189.A N ARG 185.A O no hydrogen 3.103 N/A GLY 190.A N LEU 187.A O no hydrogen 2.945 N/A GLN 191.A N ALA 186.A O no hydrogen 2.895 N/A ARG 194.A N SER 192.A OG no hydrogen 3.031 N/A ARG 194.A NE ASP 199.A OD1 no hydrogen 2.770 N/A ARG 194.A NH2 ASP 199.A OD2 no hydrogen 2.918 N/A LEU 196.A N ILE 193.A O no hydrogen 3.098 N/A GLN 202.A N PRO 198.A O no hydrogen 2.986 N/A GLU 203.A N ASP 199.A O no hydrogen 2.746 N/A TYR 204.A N LEU 200.A O no hydrogen 2.761 N/A TYR 204.A OH HIS 60.A ND1 no hydrogen 2.634 N/A ILE 205.A N VAL 201.A O no hydrogen 2.849 N/A GLU 206.A N GLN 202.A O no hydrogen 2.899 N/A LYS 207.A N GLU 203.A O no hydrogen 2.881 N/A HIS 208.A N TYR 204.A O no hydrogen 3.120 N/A ASN 209.A N GLU 206.A O no hydrogen 3.476 N/A LEU 210.A N ILE 205.A O no hydrogen 3.388 N/A TYR 211.A OH ASN 13.A OD1 no hydrogen 2.847 N/A SER 212.A N SER 215.A OG no hydrogen 2.857 N/A SER 215.A N SER 212.A OG no hydrogen 3.233 N/A SER 215.A OG LEU 210.A O no hydrogen 3.476 N/A SER 215.A OG SER 212.A O no hydrogen 3.094 N/A GLU 216.A N SER 212.A O no hydrogen 2.915 N/A ASP 217.A N SER 213.A O no hydrogen 3.248 N/A ASP 217.A N GLU 214.A O no hydrogen 2.987 N/A ARG 218.A N SER 215.A O no hydrogen 3.085 N/A ARG 218.A NE LEU 55.A O no hydrogen 2.951 N/A ASN 219.A ND2 LYS 52.A O no hydrogen 3.034 N/A ALA 220.A N ASP 217.A O no hydrogen 2.975 N/A VAL 222.A N ASN 219.A O no hydrogen 2.963 N/A ALA 225.A N TYR 50.A O no hydrogen 2.880 N/A GLN 228.A N LEU 224.A O no hydrogen 3.124 N/A ARG 229.A N ALA 225.A O no hydrogen 2.980 N/A ARG 229.A NH1 TRP 87.A O no hydrogen 3.048 N/A ARG 229.A NH1 GLU 89.A OE2 no hydrogen 2.924 N/A ARG 229.A NH2 TRP 87.A O no hydrogen 2.901 N/A ASN 230.A N PRO 226.A O no hydrogen 2.892 N/A ASN 230.A ND2 ASN 124.A O no hydrogen 2.773 N/A THR 231.A N GLN 228.A O no hydrogen 3.352 N/A THR 231.A OG1 LEU 227.A O no hydrogen 3.148 N/A