Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wnj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 ASP 6.A OD2 no hydrogen 2.726 N/A ASP 6.A N THR 3.A OG1 no hydrogen 3.084 N/A MET 7.A N THR 3.A O no hydrogen 3.155 N/A TRP 8.A N LEU 4.A O no hydrogen 2.973 N/A TRP 8.A NE1 ASN 211.A O no hydrogen 3.111 N/A LYS 9.A N GLY 5.A O no hydrogen 2.987 N/A LYS 9.A NZ ASN 147.A O no hydrogen 2.795 N/A LYS 9.A NZ GLU 153.A OE1 no hydrogen 2.653 N/A LYS 9.A NZ GLU 153.A OE2 no hydrogen 3.267 N/A ALA 10.A N ASP 6.A O no hydrogen 2.990 N/A ARG 11.A N MET 7.A O no hydrogen 2.927 N/A LEU 12.A N TRP 8.A O no hydrogen 2.828 N/A ASN 13.A N LYS 9.A O no hydrogen 2.880 N/A ASN 13.A ND2 PRO 148.A O no hydrogen 2.896 N/A SER 14.A N ALA 10.A O no hydrogen 3.102 N/A SER 14.A N ARG 11.A O no hydrogen 3.273 N/A SER 14.A OG ALA 10.A O no hydrogen 2.922 N/A SER 14.A OG ARG 11.A O no hydrogen 3.112 N/A CYS 15.A N LEU 12.A O no hydrogen 3.334 N/A CYS 15.A SG ARG 11.A O no hydrogen 3.386 N/A THR 16.A N GLU 19.A OE1 no hydrogen 2.864 N/A THR 16.A OG1 GLU 18.A OE1 no hydrogen 3.222 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.622 N/A GLU 19.A N THR 16.A OG1 no hydrogen 3.074 N/A PHE 20.A N THR 16.A O no hydrogen 2.708 N/A PHE 21.A N LYS 17.A O no hydrogen 2.967 N/A ALA 22.A N GLU 18.A O no hydrogen 2.935 N/A TYR 23.A N GLU 19.A O no hydrogen 2.927 N/A TYR 23.A N PHE 20.A O no hydrogen 3.088 N/A TYR 23.A OH LEU 237.A O no hydrogen 2.696 N/A ARG 24.A N PHE 20.A O no hydrogen 2.924 N/A ARG 25.A NE GLU 30.A OE1 no hydrogen 3.326 N/A ARG 25.A NE GLU 30.A OE2 no hydrogen 2.521 N/A ARG 25.A NH2 GLU 30.A OE1 no hydrogen 2.667 N/A ALA 26.A N TYR 23.A O no hydrogen 3.143 N/A GLY 27.A N GLY 246.A O no hydrogen 2.944 N/A VAL 28.A N ARG 25.A O no hydrogen 3.030 N/A MET 29.A N PRO 207.A O no hydrogen 2.935 N/A GLU 30.A N THR 248.A O no hydrogen 2.905 N/A THR 31.A OG1 GLU 252.A OE2 no hydrogen 2.819 N/A ASP 32.A N VAL 250.A O no hydrogen 2.781 N/A ARG 33.A NH1 ALA 50.A O no hydrogen 2.961 N/A ARG 33.A NH1 GLU 252.A OE2 no hydrogen 2.673 N/A ARG 33.A NH2 ALA 50.A O no hydrogen 3.117 N/A GLU 34.A N ASP 32.A OD1 no hydrogen 3.240 N/A ARG 37.A N ARG 33.A O no hydrogen 2.855 N/A GLU 38.A N GLU 34.A O no hydrogen 3.177 N/A LEU 39.A N LYS 35.A O no hydrogen 3.067 N/A LEU 40.A N ALA 36.A O no hydrogen 2.993 N/A LYS 41.A N ARG 37.A O no hydrogen 2.793 N/A ARG 42.A N GLU 38.A O no hydrogen 3.104 N/A ARG 42.A NH1 GLU 44.A OE1 no hydrogen 3.558 N/A GLY 43.A N LEU 40.A O no hydrogen 3.161 N/A GLU 44.A N LEU 39.A O no hydrogen 2.968 N/A ASN 46.A N GLU 44.A OE2 no hydrogen 2.956 N/A MET 47.A N THR 45.A O no hydrogen 3.074 N/A ALA 50.A N ILE 253.A O no hydrogen 3.045 N/A ARG 53.A NH1 THR 31.A O no hydrogen 2.873 N/A GLY 54.A N SER 52.A OG no hydrogen 2.986 N/A THR 55.A OG1 GLY 82.A O no hydrogen 2.843 N/A SER 56.A OG ARG 53.A O no hydrogen 3.306 N/A LYS 57.A NZ GLU 215.A OE2 no hydrogen 2.903 N/A LYS 57.A NZ TYR 217.A OH no hydrogen 2.693 N/A LEU 58.A N GLY 54.A O no hydrogen 3.178 N/A ALA 59.A N THR 55.A O no hydrogen 2.887 N/A TRP 60.A N SER 56.A O no hydrogen 2.817 N/A MET 61.A N LYS 57.A O no hydrogen 3.225 N/A GLU 62.A N LEU 58.A O no hydrogen 2.888 N/A GLU 63.A N ALA 59.A O no hydrogen 2.798 N/A ARG 64.A NH1 TRP 60.A O no hydrogen 3.138 N/A GLY 65.A N GLU 62.A O no hydrogen 2.978 N/A TYR 66.A N MET 61.A O no hydrogen 2.906 N/A LEU 69.A N GLU 62.A OE1 no hydrogen 3.113 N/A GLY 71.A N ALA 92.A O no hydrogen 2.967 N/A GLU 72.A N ASP 137.A OD2 no hydrogen 2.853 N/A VAL 73.A N SER 95.A O no hydrogen 2.863 N/A VAL 74.A N ALA 138.A O no hydrogen 2.892 N/A ASP 75.A N ARG 97.A O no hydrogen 2.926 N/A LEU 76.A N LEU 140.A O no hydrogen 2.775 N/A GLY 77.A N TYR 99.A O no hydrogen 2.785 N/A CYS 78.A N TYR 99.A O no hydrogen 2.880 N/A CYS 78.A SG GLY 79.A O no hydrogen 3.641 N/A GLY 79.A N THR 100.A OG1 no hydrogen 3.027 N/A ARG 80.A NE GLU 107.A OE1 no hydrogen 2.984 N/A ARG 80.A NH1 VAL 51.A O no hydrogen 2.915 N/A GLY 81.A N CYS 78.A O no hydrogen 2.845 N/A SER 84.A OG ASP 75.A OD2 no hydrogen 2.451 N/A TYR 85.A N GLY 81.A O no hydrogen 2.754 N/A TYR 85.A OH ARG 110.A O no hydrogen 2.472 N/A TYR 86.A N GLY 82.A O no hydrogen 3.108 N/A ALA 87.A N TRP 83.A O no hydrogen 2.917 N/A ALA 88.A N SER 84.A O no hydrogen 2.904 N/A SER 89.A N TYR 85.A O no hydrogen 3.153 N/A SER 89.A N TYR 86.A O no hydrogen 3.176 N/A SER 89.A OG TYR 86.A O no hydrogen 2.681 N/A ARG 90.A N ALA 87.A O no hydrogen 3.064 N/A ARG 90.A NE TYR 86.A O no hydrogen 3.521 N/A ARG 90.A NE SER 89.A OG no hydrogen 3.073 N/A ARG 90.A NH2 SER 89.A OG no hydrogen 2.907 N/A VAL 93.A N ARG 90.A O no hydrogen 2.975 N/A MET 94.A N GLY 71.A O no hydrogen 2.906 N/A VAL 96.A N LEU 119.A O no hydrogen 3.070 N/A ARG 97.A N VAL 73.A O no hydrogen 2.842 N/A ALA 98.A N LYS 121.A O no hydrogen 2.934 N/A TYR 99.A N ASP 75.A O no hydrogen 2.931 N/A TYR 99.A OH HIS 134.A NE2 no hydrogen 2.799 N/A THR 100.A N ARG 123.A O no hydrogen 3.124 N/A ARG 110.A N ARG 80.A O no hydrogen 2.931 N/A VAL 112.A N TYR 85.A OH no hydrogen 3.139 N/A THR 113.A N THR 45.A O no hydrogen 2.810 N/A THR 113.A OG1 THR 45.A O no hydrogen 3.235 N/A THR 113.A OG1 ASN 46.A OD1 no hydrogen 3.216 N/A LEU 115.A N GLY 256.A O no hydrogen 2.973 N/A GLY 116.A N GLY 258.A O no hydrogen 2.979 N/A TRP 117.A N SER 114.A O no hydrogen 2.819 N/A ASN 118.A ND2 ARG 260.A O no hydrogen 2.817 N/A LEU 119.A N GLY 116.A O no hydrogen 2.871 N/A ILE 120.A N TRP 117.A O no hydrogen 3.102 N/A LYS 121.A N VAL 96.A O no hydrogen 2.794 N/A ARG 123.A N ALA 98.A O no hydrogen 2.803 N/A GLY 125.A N ILE 101.A O no hydrogen 3.101 N/A MET 126.A N THR 100.A O no hydrogen 3.101 N/A PHE 129.A N ASP 127.A OD1 no hydrogen 3.197 N/A SER 130.A N ASP 127.A O no hydrogen 3.315 N/A SER 130.A OG ASP 127.A OD2 no hydrogen 2.735 N/A MET 131.A N VAL 128.A O no hydrogen 3.392 N/A HIS 134.A ND1 ARG 135.A O no hydrogen 2.876 N/A HIS 134.A NE2 TYR 99.A OH no hydrogen 2.799 N/A ARG 135.A NE GLU 72.A OE1 no hydrogen 3.039 N/A ARG 135.A NH1 ASP 137.A OD1 no hydrogen 3.569 N/A ARG 135.A NH2 GLU 72.A OE1 no hydrogen 2.599 N/A ARG 135.A NH2 ASP 137.A OD1 no hydrogen 3.248 N/A ARG 135.A NH2 ASP 137.A OD2 no hydrogen 2.915 N/A ALA 136.A N ASN 171.A OD1 no hydrogen 3.089 N/A ASP 137.A N GLU 72.A O no hydrogen 2.778 N/A ALA 138.A N GLU 72.A O no hydrogen 3.179 N/A ILE 139.A N THR 175.A O no hydrogen 2.865 N/A LEU 140.A N VAL 74.A O no hydrogen 2.818 N/A CYS 141.A N VAL 177.A O no hydrogen 3.069 N/A CYS 141.A SG LEU 76.A O no hydrogen 3.585 N/A ASN 147.A N GLU 153.A OE2 no hydrogen 2.855 N/A ASP 149.A N ASN 147.A OD1 no hydrogen 2.922 N/A VAL 151.A N ASP 149.A OD1 no hydrogen 2.872 N/A GLU 153.A N ASP 149.A O no hydrogen 3.213 N/A GLY 154.A N ALA 150.A O no hydrogen 2.872 N/A GLU 155.A N VAL 151.A O no hydrogen 3.094 N/A ARG 156.A N VAL 152.A O no hydrogen 2.967 N/A ARG 156.A NH1 GLU 145.A O no hydrogen 2.833 N/A SER 157.A N GLU 153.A O no hydrogen 2.943 N/A SER 157.A OG GLU 153.A O no hydrogen 2.852 N/A ARG 158.A N GLY 154.A O no hydrogen 2.884 N/A ARG 158.A NE GLU 155.A OE1 no hydrogen 3.322 N/A ARG 158.A NH2 GLU 155.A OE2 no hydrogen 3.040 N/A ARG 159.A N GLU 155.A O no hydrogen 2.981 N/A VAL 160.A N ARG 156.A O no hydrogen 3.187 N/A ILE 161.A N SER 157.A O no hydrogen 3.082 N/A LEU 162.A N ARG 158.A O no hydrogen 2.981 N/A LEU 163.A N ARG 159.A O no hydrogen 2.926 N/A MET 164.A N VAL 160.A O no hydrogen 2.908 N/A GLU 165.A N ILE 161.A O no hydrogen 2.898 N/A GLN 166.A N LEU 162.A O no hydrogen 3.145 N/A TRP 167.A N LEU 163.A O no hydrogen 3.079 N/A LYS 168.A N MET 164.A O no hydrogen 2.829 N/A LYS 168.A NZ PRO 172.A O no hydrogen 2.985 N/A LYS 168.A NZ ALA 174.A O no hydrogen 2.776 N/A ASN 169.A N GLU 165.A O no hydrogen 2.894 N/A ARG 170.A N GLN 166.A O no hydrogen 3.221 N/A ARG 170.A NH1 ARG 170.A O no hydrogen 3.129 N/A ASN 171.A N TRP 167.A O no hydrogen 2.916 N/A ASN 171.A ND2 HIS 134.A O no hydrogen 2.926 N/A ASN 171.A ND2 TRP 167.A O no hydrogen 3.175 N/A ALA 174.A N ASN 171.A O no hydrogen 3.103 N/A THR 175.A N ASP 137.A O no hydrogen 3.024 N/A THR 175.A OG1 ASP 137.A O no hydrogen 3.537 N/A CYS 176.A N THR 220.A OG1 no hydrogen 3.072 N/A VAL 177.A N ILE 139.A O no hydrogen 2.961 N/A PHE 178.A N PHE 218.A O no hydrogen 2.942 N/A LYS 179.A N CYS 141.A O no hydrogen 2.867 N/A LYS 179.A NZ GLY 144.A O no hydrogen 2.729 N/A VAL 180.A N MET 216.A O no hydrogen 2.719 N/A ALA 182.A N SER 157.A OG no hydrogen 2.944 N/A ARG 185.A N ALA 182.A O no hydrogen 3.359 N/A ARG 185.A NH1 ASP 6.A OD1 no hydrogen 2.939 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 2.729 N/A VAL 188.A N ARG 185.A O no hydrogen 2.946 N/A ILE 189.A N ARG 185.A O no hydrogen 2.944 N/A GLU 190.A N PRO 186.A O no hydrogen 2.954 N/A ALA 191.A N GLU 187.A O no hydrogen 3.192 N/A LEU 192.A N VAL 188.A O no hydrogen 2.844 N/A HIS 193.A N ILE 189.A O no hydrogen 2.841 N/A ARG 194.A N GLU 190.A O no hydrogen 3.117 N/A PHE 195.A N ALA 191.A O no hydrogen 2.984 N/A GLN 196.A N LEU 192.A O no hydrogen 2.778 N/A GLN 196.A NE2 GLY 201.A O no hydrogen 2.907 N/A GLN 196.A NE2 GLY 224.A O no hydrogen 2.953 N/A LEU 197.A N HIS 193.A O no hydrogen 2.920 N/A GLN 198.A N ARG 194.A O no hydrogen 3.404 N/A TRP 199.A N PHE 195.A O no hydrogen 2.840 N/A TRP 199.A NE1 GLU 165.A OE1 no hydrogen 2.924 N/A GLY 200.A N GLN 196.A O no hydrogen 2.766 N/A GLY 202.A N SER 219.A O no hydrogen 3.012 N/A VAL 204.A N TYR 217.A O no hydrogen 2.864 N/A ARG 205.A NH1 THR 213.A O no hydrogen 2.834 N/A ARG 205.A NH1 GLU 215.A O no hydrogen 2.810 N/A ARG 205.A NH2 ARG 210.A O no hydrogen 2.832 N/A ARG 205.A NH2 THR 213.A O no hydrogen 2.992 N/A THR 206.A OG1 SER 209.A OG no hydrogen 3.370 N/A PHE 208.A N THR 206.A OG1 no hydrogen 3.324 N/A SER 209.A N THR 206.A O no hydrogen 3.294 N/A SER 209.A OG THR 206.A OG1 no hydrogen 3.370 N/A SER 209.A OG GLU 215.A OE2 no hydrogen 2.508 N/A ASN 211.A N ARG 24.A O no hydrogen 2.928 N/A ASN 211.A ND2 TYR 23.A O no hydrogen 2.924 N/A ASN 211.A ND2 ALA 26.A O no hydrogen 2.803 N/A THR 213.A N ARG 210.A O no hydrogen 3.119 N/A HIS 214.A ND1 HIS 214.A O no hydrogen 2.704 N/A HIS 214.A NE2 SER 234.A OG no hydrogen 2.740 N/A GLU 215.A N THR 213.A OG1 no hydrogen 3.104 N/A MET 216.A N VAL 180.A O no hydrogen 3.075 N/A TYR 217.A N VAL 204.A O no hydrogen 2.858 N/A TYR 217.A OH ASP 142.A OD1 no hydrogen 2.701 N/A PHE 218.A N PHE 178.A O no hydrogen 2.868 N/A SER 219.A N GLY 202.A O no hydrogen 2.946 N/A SER 219.A OG TYR 66.A O no hydrogen 2.561 N/A THR 220.A N CYS 176.A O no hydrogen 3.023 N/A THR 220.A OG1 CYS 176.A O no hydrogen 3.513 N/A ALA 221.A N SER 219.A OG no hydrogen 3.097 N/A ILE 222.A N SER 219.A O no hydrogen 3.521 N/A ASN 228.A N ASN 225.A OD1 no hydrogen 2.838 N/A SER 229.A N ASN 225.A O no hydrogen 2.890 N/A SER 229.A OG ASN 225.A O no hydrogen 3.067 N/A VAL 230.A N ILE 226.A O no hydrogen 2.937 N/A ASN 231.A N VAL 227.A O no hydrogen 2.981 N/A ILE 232.A N ASN 228.A O no hydrogen 2.924 N/A GLN 233.A N SER 229.A O no hydrogen 3.206 N/A SER 234.A N VAL 230.A O no hydrogen 2.839 N/A SER 234.A OG HIS 214.A NE2 no hydrogen 2.740 N/A SER 234.A OG VAL 230.A O no hydrogen 3.155 N/A ARG 235.A N ASN 231.A O no hydrogen 2.939 N/A LYS 236.A N ILE 232.A O no hydrogen 3.049 N/A LEU 237.A N GLN 233.A O no hydrogen 2.971 N/A LEU 238.A N SER 234.A O no hydrogen 2.925 N/A ALA 239.A N ARG 235.A O no hydrogen 2.860 N/A ARG 240.A N LYS 236.A O no hydrogen 3.110 N/A ARG 240.A NH1 ASN 211.A OD1 no hydrogen 2.918 N/A PHE 241.A N LEU 238.A O no hydrogen 3.245 N/A ASP 243.A N ARG 240.A O no hydrogen 2.884 N/A ARG 245.A N ASP 243.A OD1 no hydrogen 2.778 N/A ARG 245.A NE ASP 243.A OD1 no hydrogen 3.298 N/A ARG 245.A NH2 ASP 243.A OD2 no hydrogen 3.216 N/A THR 248.A N VAL 28.A O no hydrogen 2.737 N/A VAL 250.A N GLU 30.A O no hydrogen 2.961 N/A ILE 253.A N GLU 252.A OE1 no hydrogen 2.787 N/A LEU 255.A N GLY 48.A O no hydrogen 2.725 N/A GLY 256.A N ASP 254.A OD1 no hydrogen 2.949 N/A GLY 258.A N THR 113.A O no hydrogen 2.897 N/A ARG 260.A N ASN 118.A OD1 no hydrogen 3.059 N/A ARG 260.A NH1 ALA 88.A O no hydrogen 2.797 N/A ARG 260.A NH1 VAL 93.A O no hydrogen 2.923 N/A ARG 260.A NH2 VAL 93.A O no hydrogen 3.178 N/A