Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nnq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N THR 14.A O no hydrogen 2.818 N/A THR 5.A N ARG 12.A O no hydrogen 2.847 N/A GLU 7.A N VAL 10.A O no hydrogen 2.759 N/A HIS 9.A ND1 GLU 44.A O no hydrogen 3.116 N/A VAL 10.A N GLU 7.A O no hydrogen 3.004 N/A LEU 11.A N VAL 47.A O no hydrogen 3.046 N/A ARG 12.A N THR 5.A O no hydrogen 2.758 N/A ARG 12.A NE GLU 7.A OE2 no hydrogen 2.651 N/A ARG 12.A NH1 GLU 51.A OE2 no hydrogen 3.228 N/A ARG 12.A NH1 ASP 165.A OD1 no hydrogen 2.635 N/A ARG 12.A NH2 GLU 7.A OE1 no hydrogen 3.086 N/A ARG 12.A NH2 GLU 7.A OE2 no hydrogen 3.304 N/A ALA 13.A N LEU 49.A O no hydrogen 2.670 N/A THR 14.A N ARG 3.A O no hydrogen 2.871 N/A THR 14.A OG1 GLU 51.A OE2 no hydrogen 2.635 N/A LEU 15.A N GLU 51.A O no hydrogen 2.827 N/A THR 16.A N GLY 1.A O no hydrogen 3.516 N/A SER 17.A OG ASP 19.A OD1 no hydrogen 3.363 N/A SER 17.A OG ASN 22.A OD1 no hydrogen 2.758 N/A LEU 21.A N ASP 19.A OD1 no hydrogen 2.771 N/A ASN 22.A N SER 17.A OG no hydrogen 2.852 N/A ASN 22.A ND2 THR 56.A O no hydrogen 3.179 N/A ASN 22.A ND2 PHE 57.A O no hydrogen 3.449 N/A LEU 24.A N GLY 60.A O no hydrogen 2.526 N/A SER 25.A N SER 23.A O no hydrogen 3.037 N/A ALA 28.A N SER 25.A OG no hydrogen 3.214 N/A LEU 29.A N SER 25.A O no hydrogen 2.710 N/A ASP 30.A N GLY 26.A O no hydrogen 2.882 N/A ALA 31.A N ALA 27.A O no hydrogen 3.127 N/A LEU 32.A N ALA 28.A O no hydrogen 3.144 N/A GLY 33.A N LEU 29.A O no hydrogen 3.351 N/A ALA 34.A N ASP 30.A O no hydrogen 3.090 N/A ALA 35.A N ALA 31.A O no hydrogen 2.835 N/A LEU 36.A N LEU 32.A O no hydrogen 3.036 N/A ASP 37.A N GLY 33.A O no hydrogen 3.043 N/A ARG 38.A N ALA 34.A O no hydrogen 2.907 N/A ALA 39.A N ALA 35.A O no hydrogen 2.815 N/A GLU 40.A N LEU 36.A O no hydrogen 2.881 N/A ALA 41.A N ASP 37.A O no hydrogen 3.068 N/A ASP 42.A N ARG 38.A O no hydrogen 3.216 N/A ASP 42.A N ALA 39.A O no hydrogen 3.385 N/A GLU 44.A N ASP 42.A OD1 no hydrogen 2.935 N/A CYS 45.A N ASP 42.A O no hydrogen 3.135 N/A CYS 45.A SG HIS 9.A O no hydrogen 4.050 N/A CYS 45.A SG VAL 47.A O no hydrogen 3.245 N/A ARG 46.A N HIS 9.A O no hydrogen 2.841 N/A ARG 46.A NE LEU 178.A O no hydrogen 2.844 N/A ARG 46.A NH1 LEU 178.A O no hydrogen 2.735 N/A VAL 47.A N HIS 9.A O no hydrogen 3.166 N/A LEU 48.A N ALA 79.A O no hydrogen 2.925 N/A LEU 49.A N LEU 11.A O no hydrogen 2.819 N/A LEU 50.A N VAL 81.A O no hydrogen 2.906 N/A GLU 51.A N ALA 13.A O no hydrogen 3.082 N/A SER 53.A N THR 56.A O no hydrogen 2.936 N/A SER 53.A OG LEU 15.A O no hydrogen 2.782 N/A THR 56.A N SER 53.A O no hydrogen 3.249 N/A THR 56.A OG1 GLY 20.A O no hydrogen 3.290 N/A PHE 57.A N ARG 87.A O no hydrogen 2.641 N/A CYS 58.A N ARG 87.A O no hydrogen 3.310 N/A CYS 58.A SG ASN 22.A O no hydrogen 3.333 N/A THR 59.A OG1 LEU 21.A O no hydrogen 2.523 N/A PHE 67.A N GLY 63.A O no hydrogen 3.110 N/A LEU 68.A N GLY 64.A O no hydrogen 3.011 N/A ALA 69.A N ALA 65.A O no hydrogen 3.043 N/A LEU 70.A N GLU 66.A O no hydrogen 2.773 N/A ARG 71.A NE ASP 200.A OD2 no hydrogen 2.768 N/A ARG 71.A NH2 ASP 200.A OD1 no hydrogen 3.191 N/A ARG 72.A N ALA 69.A O no hydrogen 3.109 N/A ARG 72.A NH1 GLY 33.A O no hydrogen 3.013 N/A ARG 72.A NH2 ASP 37.A OD1 no hydrogen 2.758 N/A ARG 72.A NH2 GLU 40.A OE1 no hydrogen 2.785 N/A PHE 73.A N LEU 70.A O no hydrogen 3.099 N/A GLU 75.A N ARG 72.A O no hydrogen 2.795 N/A THR 76.A N ARG 72.A O no hydrogen 2.638 N/A THR 76.A OG1 GLU 40.A OE2 no hydrogen 2.975 N/A ALA 79.A N ARG 46.A O no hydrogen 2.886 N/A VAL 80.A N ASP 100.A OD2 no hydrogen 2.710 N/A VAL 81.A N LEU 48.A O no hydrogen 2.940 N/A ALA 82.A N LEU 101.A O no hydrogen 2.796 N/A CYS 83.A N LEU 50.A O no hydrogen 2.693 N/A VAL 84.A N ILE 103.A O.A no hydrogen 2.768 N/A VAL 84.A N ILE 103.A O.B no hydrogen 2.797 N/A GLY 86.A N SER 108.A OG no hydrogen 3.071 N/A ARG 87.A N GLY 55.A O no hydrogen 2.850 N/A ARG 87.A NH1 THR 56.A OG1 no hydrogen 3.159 N/A ALA 88.A N GLU 109.A O no hydrogen 2.948 N/A ALA 89.A N CYS 58.A O no hydrogen 3.057 N/A GLY 90.A N SER 111.A O no hydrogen 2.878 N/A GLY 92.A N ALA 89.A O no hydrogen 2.844 N/A VAL 93.A N GLY 90.A O no hydrogen 2.981 N/A LEU 95.A N GLY 91.A O no hydrogen 3.033 N/A ALA 96.A N GLY 92.A O no hydrogen 3.224 N/A ALA 97.A N VAL 93.A O no hydrogen 2.649 N/A ALA 98.A N GLY 94.A O no hydrogen 2.925 N/A ALA 99.A N ALA 96.A O no hydrogen 3.010 N/A ASP 100.A N VAL 80.A O no hydrogen 2.711 N/A LEU 101.A N VAL 80.A O no hydrogen 3.274 N/A VAL 102.A N ASP 158.A OD2 no hydrogen 2.845 N/A ILE 103.A N.A ALA 82.A O no hydrogen 2.882 N/A ILE 103.A N.B ALA 82.A O no hydrogen 2.889 N/A ALA 104.A N GLU 159.A O no hydrogen 2.982 N/A THR 105.A N VAL 84.A O no hydrogen 3.029 N/A THR 105.A OG1 ASP 85.A OD1 no hydrogen 2.646 N/A THR 105.A OG1 SER 108.A OG no hydrogen 3.284 N/A ARG 107.A NE ASP 85.A OD1 no hydrogen 2.966 N/A ARG 107.A NH1 ASP 85.A OD1 no hydrogen 3.551 N/A ARG 107.A NH1 ASP 85.A OD2 no hydrogen 3.213 N/A SER 108.A N THR 105.A O no hydrogen 3.128 N/A SER 108.A OG VAL 84.A O no hydrogen 3.159 N/A SER 108.A OG THR 105.A O no hydrogen 3.118 N/A SER 108.A OG THR 105.A OG1 no hydrogen 3.284 N/A GLU 109.A N GLY 86.A O no hydrogen 3.131 N/A PHE 110.A N VAL 146.A O no hydrogen 2.880 N/A SER 111.A N ALA 88.A O no hydrogen 3.033 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.898 N/A LEU 116.A N PRO 113.A O no hydrogen 2.964 N/A TRP 117.A N GLU 114.A O no hydrogen 3.087 N/A GLY 118.A N ALA 115.A O no hydrogen 3.103 N/A LEU 119.A N GLU 114.A O no hydrogen 2.931 N/A CYS 122.A N VAL 120.A O no hydrogen 2.834 N/A CYS 122.A SG VAL 120.A O no hydrogen 3.830 N/A VAL 124.A N PRO 121.A O no hydrogen 3.120 N/A LEU 125.A N PRO 121.A O no hydrogen 3.152 N/A LEU 128.A N VAL 124.A O no hydrogen 2.938 N/A VAL 129.A N LEU 125.A O no hydrogen 2.732 N/A ARG 130.A N PRO 126.A O no hydrogen 3.383 N/A ARG 131.A N VAL 127.A O no hydrogen 3.234 N/A ARG 131.A NE ALA 97.A O no hydrogen 3.000 N/A ARG 131.A NH1 ALA 99.A O no hydrogen 2.975 N/A ARG 131.A NH1 ASP 100.A O no hydrogen 3.127 N/A ARG 131.A NH1 ASP 158.A OD2 no hydrogen 3.475 N/A ARG 131.A NH2 ARG 155.A O no hydrogen 2.913 N/A ARG 131.A NH2 ASP 158.A OD2 no hydrogen 2.871 N/A THR 132.A N LEU 128.A O no hydrogen 2.965 N/A THR 132.A OG1 LEU 128.A O no hydrogen 3.178 N/A THR 132.A OG1 GLY 133.A O no hydrogen 2.700 N/A GLY 133.A N VAL 129.A O no hydrogen 2.717 N/A TYR 138.A N PHE 134.A O no hydrogen 2.989 N/A ALA 139.A N GLN 135.A O no hydrogen 2.909 N/A LEU 141.A N TYR 138.A O no hydrogen 2.914 N/A SER 142.A N ALA 139.A O no hydrogen 2.919 N/A SER 142.A OG ALA 139.A O no hydrogen 3.160 N/A THR 143.A OG1 SER 142.A O no hydrogen 2.723 N/A GLN 144.A N SER 142.A OG no hydrogen 3.159 N/A VAL 146.A N PHE 110.A O no hydrogen 2.677 N/A ALA 148.A N SER 108.A O no hydrogen 2.882 N/A ARG 150.A N SER 147.A OG no hydrogen 3.137 N/A ARG 150.A NH1 ASP 153.A OD2 no hydrogen 2.999 N/A ALA 151.A N SER 147.A O no hydrogen 2.909 N/A ALA 152.A N ALA 148.A O no hydrogen 2.817 N/A ASP 153.A N ARG 149.A O no hydrogen 3.343 N/A ASP 153.A N ARG 150.A O no hydrogen 3.153 N/A PHE 154.A N ALA 151.A O no hydrogen 3.378 N/A ARG 155.A N ALA 152.A O no hydrogen 3.213 N/A ARG 155.A NE ASP 158.A OD1 no hydrogen 3.294 N/A ARG 155.A NH2 ASP 158.A OD1 no hydrogen 2.771 N/A LEU 156.A N ALA 151.A O no hydrogen 2.881 N/A VAL 157.A N ALA 151.A O no hydrogen 3.322 N/A ASP 158.A N VAL 102.A O no hydrogen 2.736 N/A GLU 159.A N VAL 102.A O no hydrogen 3.368 N/A VAL 161.A N ALA 104.A O no hydrogen 2.835 N/A ASP 165.A N ASP 163.A OD1 no hydrogen 3.247 N/A ALA 166.A N ASP 163.A O no hydrogen 3.230 N/A ALA 167.A N ASP 163.A O no hydrogen 3.258 N/A VAL 168.A N PRO 164.A O no hydrogen 2.973 N/A ARG 169.A N ASP 165.A O no hydrogen 3.048 N/A ARG 170.A N ALA 166.A O no hydrogen 2.892 N/A LEU 171.A N ALA 167.A O no hydrogen 2.931 N/A LEU 172.A N VAL 168.A O no hydrogen 3.027 N/A VAL 173.A N ARG 170.A O no hydrogen 3.191 N/A LEU 175.A N LEU 171.A O no hydrogen 3.068 N/A THR 176.A N LEU 172.A O no hydrogen 2.987 N/A THR 176.A OG1 LEU 172.A O no hydrogen 2.742 N/A THR 176.A OG1 VAL 173.A O no hydrogen 3.346 N/A ARG 177.A N ARG 174.A O no hydrogen 3.207 N/A LEU 178.A N LEU 175.A O no hydrogen 3.048 N/A ALA 181.A N ASP 179.A OD1 no hydrogen 2.879 N/A THR 182.A N ASP 179.A O no hydrogen 2.825 N/A THR 182.A OG1 ASP 179.A O no hydrogen 3.521 N/A ILE 183.A N ASP 179.A O no hydrogen 3.324 N/A GLY 184.A N PRO 180.A O no hydrogen 3.001 N/A GLU 185.A N ALA 181.A O no hydrogen 2.961 N/A LEU 186.A N THR 182.A O no hydrogen 2.834 N/A LYS 187.A N ILE 183.A O no hydrogen 3.022 N/A LYS 187.A NZ PHE 73.A O no hydrogen 2.626 N/A LYS 187.A NZ THR 76.A O no hydrogen 2.861 N/A LYS 187.A NZ LEU 78.A O no hydrogen 2.854 N/A LYS 187.A NZ ASP 100.A OD1 no hydrogen 3.303 N/A LYS 187.A NZ ASP 100.A OD2 no hydrogen 2.895 N/A GLN 188.A N GLY 184.A O no hydrogen 3.073 N/A TYR 189.A N GLU 185.A O no hydrogen 3.032 N/A PHE 190.A N LEU 186.A O no hydrogen 2.890 N/A ARG 191.A N LYS 187.A O no hydrogen 3.079 N/A ARG 191.A N GLN 188.A O no hydrogen 3.169 N/A ARG 191.A NH1 GLY 74.A O no hydrogen 3.090 N/A ALA 192.A N TYR 189.A O no hydrogen 3.006 N/A THR 196.A N THR 199.A OG1 no hydrogen 3.101 N/A THR 196.A OG1 ASP 198.A OD2 no hydrogen 3.378 N/A ASP 198.A N THR 196.A OG1 no hydrogen 3.101 N/A THR 199.A N THR 196.A O no hydrogen 3.137 N/A THR 199.A OG1 THR 196.A O no hydrogen 3.123 N/A ASP 200.A N GLU 197.A O no hydrogen 3.183 N/A PHE 202.A N ASP 198.A O no hydrogen 3.184 N/A ALA 203.A N THR 199.A O no hydrogen 3.014 N/A LEU 204.A N ASP 200.A O no hydrogen 3.146 N/A ARG 205.A N ALA 201.A O no hydrogen 2.972 N/A GLU 206.A N PHE 202.A O no hydrogen 2.806 N/A PHE 207.A N ALA 203.A O no hydrogen 2.899 N/A THR 208.A N LEU 204.A O no hydrogen 2.992 N/A THR 208.A OG1 LEU 204.A O no hydrogen 2.877 N/A THR 208.A OG1 ARG 205.A O no hydrogen 2.997 N/A ARG 209.A N ARG 205.A O no hydrogen 3.063 N/A ARG 209.A NH1 GLU 206.A OE1 no hydrogen 3.020 N/A LEU 210.A N GLU 206.A O no hydrogen 2.979 N/A ILE 211.A N PHE 207.A O no hydrogen 2.837 N/A ASP 212.A N ARG 209.A O no hydrogen 3.169 N/A SER 213.A N LEU 210.A O no hydrogen 2.910 N/A SER 213.A OG LEU 210.A O no hydrogen 2.615 N/A ARG 217.A N SER 213.A O no hydrogen 2.911 N/A ARG 218.A N PRO 214.A O no hydrogen 3.252 N/A ARG 219.A N VAL 215.A O no hydrogen 3.067 N/A ARG 219.A NH1 LEU 116.A O no hydrogen 2.868 N/A ILE 220.A N ALA 216.A O no hydrogen 2.906 N/A THR 221.A N ARG 217.A O no hydrogen 2.987 N/A THR 221.A OG1 ARG 217.A O no hydrogen 2.631 N/A ASP 222.A N ARG 218.A O no hydrogen 3.160 N/A TYR 223.A N ARG 219.A O no hydrogen 2.934 N/A THR 224.A N ILE 220.A O no hydrogen 3.048 N/A THR 224.A OG1 ILE 220.A O no hydrogen 2.895 N/A THR 224.A OG1 THR 221.A O no hydrogen 3.075 N/A THR 225.A N ASP 222.A O no hydrogen 3.356 N/A THR 225.A OG1 THR 221.A O no hydrogen 2.847 N/A