Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qkn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG GLU 5.A OE2 no hydrogen 3.191 N/A GLU 5.A N GLU 5.A OE2 no hydrogen 2.532 N/A GLN 6.A N SER 3.A OG no hydrogen 2.574 N/A LEU 7.A N SER 3.A O no hydrogen 2.989 N/A VAL 8.A N PRO 4.A O no hydrogen 2.975 N/A LEU 9.A N GLU 5.A O no hydrogen 2.940 N/A THR 10.A N GLN 6.A O no hydrogen 2.740 N/A THR 10.A OG1 GLN 6.A O no hydrogen 3.088 N/A THR 10.A OG1 GLN 6.A OE1 no hydrogen 3.363 N/A LEU 11.A N LEU 7.A O no hydrogen 3.001 N/A LEU 12.A N VAL 8.A O no hydrogen 2.987 N/A GLU 13.A N LEU 9.A O no hydrogen 3.093 N/A ALA 14.A N THR 10.A O no hydrogen 2.851 N/A ALA 14.A N LEU 11.A O no hydrogen 3.010 N/A GLU 15.A N LEU 12.A O no hydrogen 3.168 N/A ARG 23.A NH2 VAL 100.A O no hydrogen 2.609 N/A MET 35.A N ALA 31.A O no hydrogen 3.258 N/A SER 36.A N SER 32.A O no hydrogen 3.091 N/A SER 36.A OG SER 32.A O no hydrogen 3.183 N/A LEU 37.A N MET 33.A O no hydrogen 3.099 N/A THR 38.A N MET 34.A O no hydrogen 2.631 N/A THR 38.A OG1 MET 34.A O no hydrogen 3.231 N/A LYS 39.A N MET 35.A O no hydrogen 3.114 N/A LEU 40.A N SER 36.A O no hydrogen 2.825 N/A ALA 41.A N LEU 37.A O no hydrogen 2.988 N/A ASP 42.A N THR 38.A O no hydrogen 3.119 N/A LYS 43.A N LYS 39.A O no hydrogen 3.121 N/A GLU 44.A N LEU 40.A O no hydrogen 2.991 N/A LEU 45.A N ALA 41.A O no hydrogen 2.692 N/A VAL 46.A N ASP 42.A O no hydrogen 3.324 N/A HIS 47.A N LYS 43.A O no hydrogen 3.320 N/A MET 48.A N GLU 44.A O no hydrogen 2.762 N/A ILE 49.A N LEU 45.A O no hydrogen 3.404 N/A ILE 49.A N VAL 46.A O no hydrogen 3.332 N/A TRP 51.A N HIS 47.A O no hydrogen 2.861 N/A ALA 52.A N MET 48.A O no hydrogen 2.876 N/A LYS 53.A N ILE 49.A O no hydrogen 3.156 N/A LYS 53.A NZ MET 225.A O no hydrogen 2.557 N/A LYS 53.A NZ LEU 226.A O no hydrogen 2.746 N/A LYS 54.A N TRP 51.A O no hydrogen 2.935 N/A ILE 55.A N ALA 52.A O no hydrogen 2.966 N/A PHE 58.A N ILE 55.A O no hydrogen 2.884 N/A GLU 60.A N GLY 57.A O no hydrogen 2.930 N/A LEU 61.A N PHE 58.A O no hydrogen 3.150 N/A ASP 65.A N SER 62.A OG no hydrogen 2.801 N/A GLN 66.A N SER 62.A O no hydrogen 2.995 N/A GLN 66.A NE2 LEU 61.A O no hydrogen 2.803 N/A VAL 67.A N LEU 63.A O no hydrogen 2.802 N/A ARG 68.A N LEU 64.A O no hydrogen 3.031 N/A ARG 68.A NE LEU 64.A O no hydrogen 3.291 N/A ARG 68.A NH1 PRO 151.A O no hydrogen 2.976 N/A ARG 68.A NH1 GLU 158.A OE2 no hydrogen 3.126 N/A ARG 68.A NH2 ASP 65.A OD1 no hydrogen 2.567 N/A LEU 69.A N ASP 65.A O no hydrogen 2.796 N/A LEU 70.A N GLN 66.A O no hydrogen 3.164 N/A GLU 71.A N VAL 67.A O no hydrogen 3.009 N/A SER 72.A N ARG 68.A O no hydrogen 3.093 N/A SER 72.A OG.A ARG 68.A O no hydrogen 3.377 N/A SER 72.A OG.A LEU 69.A O no hydrogen 3.550 N/A SER 72.A OG.A SER 147.A OG no hydrogen 2.563 N/A SER 72.A OG.A SER 148.A O no hydrogen 2.448 N/A SER 72.A OG.B SER 148.A O no hydrogen 3.031 N/A CYS 73.A N LEU 69.A O no hydrogen 3.025 N/A CYS 73.A SG LEU 69.A O no hydrogen 3.357 N/A TRP 74.A N LEU 70.A O no hydrogen 3.239 N/A VAL 77.A N CYS 73.A O no hydrogen 2.819 N/A LEU 78.A N TRP 74.A O no hydrogen 2.881 N/A MET 79.A N MET 75.A O no hydrogen 2.735 N/A VAL 80.A N GLU 76.A O no hydrogen 2.770 N/A GLY 81.A N VAL 77.A O no hydrogen 3.089 N/A LEU 82.A N LEU 78.A O no hydrogen 3.077 N/A MET 83.A N MET 79.A O no hydrogen 2.844 N/A TRP 84.A N VAL 80.A O no hydrogen 2.969 N/A ARG 85.A N GLY 81.A O no hydrogen 2.891 N/A ARG 85.A NE ILE 94.A O no hydrogen 3.072 N/A ARG 85.A NH2 PHE 95.A O no hydrogen 3.124 N/A SER 86.A N LEU 82.A O no hydrogen 2.898 N/A SER 86.A OG LEU 82.A O no hydrogen 2.733 N/A HIS 89.A N SER 86.A O no hydrogen 2.914 N/A LYS 92.A N HIS 89.A O no hydrogen 2.978 N/A LEU 93.A N LEU 101.A O no hydrogen 2.908 N/A ILE 94.A N SER 86.A OG no hydrogen 2.926 N/A ALA 96.A N LEU 99.A O no hydrogen 3.386 N/A LEU 99.A N ALA 96.A O no hydrogen 2.876 N/A LEU 101.A N LEU 93.A O no hydrogen 3.119 N/A ASP 102.A N GLU 105.A OE2 no hydrogen 3.058 N/A ARG 103.A N GLY 91.A O no hydrogen 2.967 N/A ARG 103.A N ASP 102.A OD1 no hydrogen 2.691 N/A ARG 103.A NE ASP 117.A OD1 no hydrogen 2.680 N/A ARG 103.A NH2 ASP 117.A OD1 no hydrogen 3.329 N/A ARG 103.A NH2 ASP 117.A OD2 no hydrogen 2.491 N/A GLU 105.A N ASP 102.A O no hydrogen 3.031 N/A GLY 106.A N ARG 103.A O no hydrogen 3.385 N/A LYS 107.A N ASP 104.A O no hydrogen 3.472 N/A LYS 107.A NZ ASP 104.A O no hydrogen 3.489 N/A CYS 108.A SG GLU 105.A O no hydrogen 3.403 N/A GLY 111.A N VAL 109.A O no hydrogen 2.809 N/A PHE 116.A N ILE 112.A O no hydrogen 2.742 N/A ASP 117.A N LEU 113.A O no hydrogen 2.847 N/A MET 118.A N GLU 114.A O no hydrogen 3.075 N/A LEU 119.A N ILE 115.A O no hydrogen 3.117 N/A LEU 120.A N PHE 116.A O no hydrogen 2.948 N/A ALA 121.A N ASP 117.A O no hydrogen 2.800 N/A THR 122.A N MET 118.A O no hydrogen 2.774 N/A THR 122.A OG1 MET 118.A O no hydrogen 3.258 N/A THR 123.A N LEU 119.A O no hydrogen 2.928 N/A THR 123.A OG1 LEU 119.A O no hydrogen 2.529 N/A SER 124.A N LEU 120.A O no hydrogen 2.704 N/A SER 124.A OG LEU 120.A O no hydrogen 2.872 N/A ARG 125.A N ALA 121.A O no hydrogen 2.796 N/A ARG 125.A NE GLU 128.A OE1 no hydrogen 2.359 N/A ARG 125.A NH2 GLU 128.A OE1 no hydrogen 3.042 N/A ARG 125.A NH2 GLU 128.A OE2 no hydrogen 2.425 N/A PHE 126.A N THR 122.A O no hydrogen 3.094 N/A ARG 127.A N THR 123.A O no hydrogen 2.939 N/A ARG 127.A NE ILE 87.A O no hydrogen 2.948 N/A ARG 127.A NH1 SER 124.A OG no hydrogen 3.209 N/A ARG 127.A NH2 ILE 87.A O no hydrogen 3.043 N/A GLU 128.A N SER 124.A O no hydrogen 2.705 N/A LEU 129.A N ARG 125.A O no hydrogen 2.755 N/A LYS 130.A N ARG 127.A O no hydrogen 2.731 N/A LEU 131.A N PHE 126.A O no hydrogen 3.027 N/A GLN 132.A N GLU 135.A OE1 no hydrogen 2.747 N/A TYR 136.A N GLN 132.A O no hydrogen 2.837 N/A LEU 137.A N HIS 133.A O no hydrogen 3.040 N/A CYS 138.A N LYS 134.A O no hydrogen 3.340 N/A CYS 138.A SG LYS 134.A O no hydrogen 3.526 N/A VAL 139.A N GLU 135.A O no hydrogen 2.901 N/A LYS 140.A N TYR 136.A O no hydrogen 2.942 N/A LYS 140.A NZ GLU 15.A OE1 no hydrogen 3.137 N/A LYS 140.A NZ GLU 15.A OE2 no hydrogen 2.613 N/A LYS 140.A NZ TYR 136.A OH no hydrogen 3.212 N/A ALA 141.A N LEU 137.A O no hydrogen 3.139 N/A MET 142.A N CYS 138.A O no hydrogen 2.842 N/A ILE 143.A N VAL 139.A O no hydrogen 2.987 N/A LEU 144.A N LYS 140.A O no hydrogen 3.316 N/A LEU 145.A N ALA 141.A O no hydrogen 3.022 N/A ASN 146.A N MET 142.A O no hydrogen 2.857 N/A SER 147.A N LEU 144.A O no hydrogen 3.464 N/A SER 147.A OG LEU 69.A O no hydrogen 3.260 N/A SER 147.A OG SER 72.A OG.A no hydrogen 2.563 N/A ALA 153.A N GLU 158.A OE2 no hydrogen 2.823 N/A SER 154.A N GLN 157.A OE1 no hydrogen 3.097 N/A GLN 157.A N SER 154.A OG no hydrogen 2.887 N/A GLU 158.A N SER 154.A O no hydrogen 2.826 N/A ALA 159.A N ALA 155.A O no hydrogen 3.003 N/A GLU 160.A N ASN 156.A O no hydrogen 3.334 N/A SER 161.A N GLN 157.A O no hydrogen 3.065 N/A SER 161.A OG ASP 65.A OD1 no hydrogen 3.122 N/A SER 161.A OG ASP 65.A OD2 no hydrogen 2.327 N/A SER 162.A N GLU 158.A O no hydrogen 2.838 N/A SER 162.A OG GLU 158.A O no hydrogen 3.416 N/A ARG 163.A N ALA 159.A O no hydrogen 2.921 N/A LYS 164.A N GLU 160.A O no hydrogen 3.386 N/A LEU 165.A N SER 161.A O no hydrogen 2.923 N/A THR 166.A N SER 162.A O no hydrogen 2.775 N/A THR 166.A OG1 SER 162.A O no hydrogen 3.093 N/A HIS 167.A N ARG 163.A O no hydrogen 2.938 N/A LEU 168.A N LYS 164.A O no hydrogen 3.083 N/A LEU 169.A N LEU 165.A O no hydrogen 2.826 N/A ASN 170.A N THR 166.A O no hydrogen 2.863 N/A ALA 171.A N HIS 167.A O no hydrogen 3.414 N/A VAL 172.A N LEU 168.A O no hydrogen 3.243 N/A THR 173.A N LEU 169.A O no hydrogen 2.887 N/A THR 173.A OG1 LEU 169.A O no hydrogen 3.298 N/A ASP 174.A N ASN 170.A O no hydrogen 2.898 N/A ALA 175.A N ALA 171.A O no hydrogen 3.092 N/A LEU 176.A N VAL 172.A O no hydrogen 2.802 N/A VAL 177.A N THR 173.A O no hydrogen 2.809 N/A TRP 178.A N ASP 174.A O no hydrogen 3.007 N/A VAL 179.A N ALA 175.A O no hydrogen 2.873 N/A ILE 180.A N LEU 176.A O no hydrogen 2.751 N/A ALA 181.A N VAL 177.A O no hydrogen 2.799 N/A LYS 182.A N TRP 178.A O no hydrogen 3.303 N/A LYS 182.A N VAL 179.A O no hydrogen 3.164 N/A SER 183.A N ILE 180.A O no hydrogen 3.172 N/A SER 183.A OG ILE 180.A O no hydrogen 3.190 N/A GLY 184.A N ALA 181.A O no hydrogen 3.239 N/A GLN 189.A N SER 186.A OG no hydrogen 3.254 N/A GLN 189.A NE2 GLN 188.A OE1 no hydrogen 2.846 N/A GLN 190.A N SER 186.A O no hydrogen 2.768 N/A GLN 190.A NE2 ILE 185.A O no hydrogen 2.979 N/A SER 191.A N SER 187.A O no hydrogen 3.171 N/A VAL 192.A N GLN 188.A O no hydrogen 3.114 N/A ARG 193.A N GLN 189.A O no hydrogen 2.892 N/A ARG 193.A NE GLU 135.A OE2 no hydrogen 2.634 N/A ARG 193.A NH1 LEU 129.A O no hydrogen 3.074 N/A ARG 193.A NH2 LEU 129.A O no hydrogen 3.028 N/A ARG 193.A NH2 LYS 130.A O no hydrogen 3.144 N/A ARG 193.A NH2 GLU 135.A OE1 no hydrogen 2.756 N/A ARG 193.A NH2 GLU 135.A OE2 no hydrogen 3.432 N/A LEU 194.A N GLN 190.A O no hydrogen 2.938 N/A ALA 195.A N SER 191.A O no hydrogen 2.854 N/A ASN 196.A N VAL 192.A O no hydrogen 2.758 N/A LEU 197.A N ARG 193.A O no hydrogen 3.078 N/A LEU 198.A N LEU 194.A O no hydrogen 2.963 N/A MET 199.A N ALA 195.A O no hydrogen 2.876 N/A LEU 200.A N ASN 196.A O no hydrogen 3.392 N/A LEU 200.A N LEU 197.A O no hydrogen 3.225 N/A LEU 201.A N LEU 198.A O no hydrogen 2.882 N/A SER 202.A N MET 199.A O no hydrogen 3.211 N/A SER 202.A OG.A MET 199.A O no hydrogen 3.180 N/A VAL 204.A N LEU 200.A O no hydrogen 3.030 N/A ARG 205.A N LEU 201.A O no hydrogen 3.081 N/A ARG 205.A NE GLU 76.A OE2 no hydrogen 2.760 N/A ARG 205.A NH1 SER 148.A OG no hydrogen 3.230 N/A ARG 205.A NH2 ASN 146.A O no hydrogen 3.095 N/A HIS 206.A N SER 202.A O no hydrogen 3.066 N/A ILE 207.A N HIS 203.A O no hydrogen 2.889 N/A SER 208.A N VAL 204.A O no hydrogen 3.020 N/A ASN 209.A N ARG 205.A O no hydrogen 2.907 N/A LYS 210.A N HIS 206.A O no hydrogen 3.162 N/A GLY 211.A N ILE 207.A O no hydrogen 2.857 N/A MET 212.A N SER 208.A O no hydrogen 2.758 N/A GLU 213.A N ASN 209.A O no hydrogen 3.074 N/A HIS 214.A N LYS 210.A O no hydrogen 2.716 N/A HIS 214.A NE2 GLU 110.A O no hydrogen 2.931 N/A LEU 215.A N GLY 211.A O no hydrogen 2.815 N/A LEU 216.A N MET 212.A O no hydrogen 3.038 N/A SER 217.A OG HIS 214.A O no hydrogen 3.155 N/A MET 218.A N LEU 215.A O no hydrogen 3.175 N/A MET 225.A N LEU 221.A O no hydrogen 3.089 N/A LEU 226.A N LEU 222.A O no hydrogen 2.676 N/A ASN 227.A N LEU 223.A O no hydrogen 2.761 N/A ASN 227.A ND2 LEU 223.A O no hydrogen 3.327 N/A