Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4h16_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N LEU 31.A O no hydrogen 2.843 N/A ARG 7.A N ASN 5.A OD1 no hydrogen 3.045 N/A ARG 7.A NH1 GLU 2.A OE1 no hydrogen 3.212 N/A ARG 7.A NH1 GLU 2.A OE2 no hydrogen 3.182 N/A ARG 7.A NH2 GLU 2.A OE1 no hydrogen 2.634 N/A LYS 9.A N LEU 6.A O no hydrogen 3.111 N/A LYS 9.A NZ ASP 234.A OD1 no hydrogen 3.333 N/A LYS 9.A NZ ASP 234.A OD2 no hydrogen 3.530 N/A ARG 10.A N ASP 77.A OD2 no hydrogen 2.813 N/A ARG 10.A NE ASP 77.A OD2 no hydrogen 2.820 N/A ARG 10.A NH2 ASP 77.A OD1 no hydrogen 2.851 N/A ARG 10.A NH2 ASP 77.A OD2 no hydrogen 3.460 N/A ALA 11.A N GLN 34.A O no hydrogen 2.778 N/A LEU 12.A N VAL 78.A O no hydrogen 2.949 N/A ILE 13.A N LEU 36.A O no hydrogen 2.962 N/A THR 14.A N VAL 80.A O no hydrogen 2.998 N/A ALA 15.A N THR 38.A OG1 no hydrogen 2.836 N/A GLY 16.A N THR 38.A O no hydrogen 3.371 N/A ALA 22.A N LYS 18.A O no hydrogen 3.124 N/A ALA 23.A N GLY 19.A O no hydrogen 3.114 N/A THR 24.A N ALA 20.A O no hydrogen 2.884 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.703 N/A VAL 25.A N GLY 21.A O no hydrogen 3.004 N/A SER 26.A N ALA 22.A O no hydrogen 2.899 N/A LEU 27.A N ALA 23.A O no hydrogen 2.904 N/A PHE 28.A N THR 24.A O no hydrogen 2.911 N/A LEU 29.A N VAL 25.A O no hydrogen 3.027 N/A GLU 30.A N SER 26.A O no hydrogen 3.048 N/A LEU 31.A N LEU 27.A O no hydrogen 2.957 N/A LEU 31.A N PHE 28.A O no hydrogen 3.194 N/A GLY 32.A N LEU 29.A O no hydrogen 3.178 N/A ALA 33.A N PHE 28.A O no hydrogen 2.966 N/A GLN 34.A N LYS 9.A O no hydrogen 2.890 N/A LEU 36.A N ALA 11.A O no hydrogen 2.831 N/A THR 37.A N LEU 50.A O no hydrogen 2.810 N/A THR 37.A OG1 ILE 13.A O no hydrogen 2.599 N/A THR 38.A N THR 37.A OG1 no hydrogen 2.813 N/A ALA 39.A N VAL 52.A O no hydrogen 3.376 N/A ARG 40.A NH2.A ASP 55.A OD1 no hydrogen 3.402 N/A ARG 42.A N GLU 53.A OE2 no hydrogen 2.913 N/A ARG 42.A NE.B PHE 51.A O no hydrogen 3.261 N/A ARG 42.A NH1.A GLU 44.A O no hydrogen 3.293 N/A ARG 42.A NH1.A LEU 46.A O no hydrogen 2.741 N/A ARG 42.A NH1.B GLU 48.A OE2.A no hydrogen 3.142 N/A ARG 42.A NH2.B PHE 51.A O no hydrogen 2.832 N/A GLY 45.A N GLU 44.A OE1 no hydrogen 2.879 N/A GLU 48.A N GLU 48.A OE1.B no hydrogen 2.457 N/A GLU 49.A N GLU 49.A OE1.B no hydrogen 2.626 N/A LEU 50.A N PRO 47.A O no hydrogen 3.036 N/A PHE 51.A N GLU 48.A O no hydrogen 3.293 N/A VAL 52.A N THR 37.A O no hydrogen 2.859 N/A ALA 54.A N ALA 39.A O no hydrogen 2.905 N/A THR 57.A N ASP 55.A OD1 no hydrogen 3.005 N/A THR 57.A OG1 ASP 55.A OD1 no hydrogen 2.656 N/A THR 57.A OG1 ASP 55.A OD2 no hydrogen 3.424 N/A THR 58.A N ASP 55.A O no hydrogen 3.091 N/A THR 58.A OG1 ASP 55.A O no hydrogen 2.917 N/A LYS 59.A NZ GLU 60.A OE2 no hydrogen 2.877 N/A GLY 61.A N THR 58.A OG1 no hydrogen 2.989 N/A CYS 62.A N THR 58.A O no hydrogen 3.134 N/A CYS 62.A SG LEU 56.A O no hydrogen 3.300 N/A CYS 62.A SG THR 58.A O no hydrogen 3.547 N/A ALA 63.A N LYS 59.A O no hydrogen 3.063 N/A ILE 64.A N GLU 60.A O no hydrogen 2.985 N/A VAL 65.A N GLY 61.A O no hydrogen 2.989 N/A ALA 66.A N CYS 62.A O no hydrogen 2.960 N/A GLU 67.A N ALA 63.A O no hydrogen 3.204 N/A ALA 68.A N ILE 64.A O no hydrogen 2.885 N/A THR 69.A N VAL 65.A O no hydrogen 2.843 N/A THR 69.A OG1 VAL 65.A O no hydrogen 2.803 N/A ARG 70.A N ALA 66.A O no hydrogen 3.141 N/A ARG 70.A NE GLU 67.A OE1 no hydrogen 3.006 N/A ARG 70.A NH1 GLN 117.A OE1 no hydrogen 2.872 N/A ARG 70.A NH2 GLU 67.A OE1 no hydrogen 2.904 N/A ARG 70.A NH2 GLN 117.A OE1 no hydrogen 3.439 N/A GLN 71.A N GLU 67.A O no hydrogen 2.941 N/A GLN 71.A NE2 GLU 67.A OE2 no hydrogen 2.822 N/A ARG 72.A N ALA 68.A O no hydrogen 2.802 N/A ARG 72.A NH1 GLU 48.A O no hydrogen 3.158 N/A ARG 72.A NH1 GLU 49.A O no hydrogen 3.084 N/A ARG 72.A NH1 PHE 51.A O no hydrogen 2.688 N/A ARG 72.A NH2 PHE 51.A O no hydrogen 3.096 N/A LEU 73.A N THR 69.A O no hydrogen 2.827 N/A ASP 77.A N ARG 10.A O no hydrogen 2.807 N/A VAL 78.A N ARG 10.A O no hydrogen 3.008 N/A ILE 79.A N VAL 128.A O no hydrogen 2.945 N/A VAL 80.A N LEU 12.A O no hydrogen 2.786 N/A HIS 81.A N VAL 130.A O no hydrogen 2.853 N/A HIS 81.A NE2 ASP 115.A OD1 no hydrogen 2.694 N/A GLY 84.A N ASN 107.A OD1 no hydrogen 2.787 N/A SER 85.A OG GLU 103.A OE2 no hydrogen 2.531 N/A GLY 90.A N GLU 143.A OE2 no hydrogen 2.694 N/A GLY 91.A N GLU 143.A O no hydrogen 2.885 N/A ALA 94.A N GLY 91.A O no hydrogen 3.062 N/A LEU 95.A N PHE 92.A O no hydrogen 3.206 N/A SER 96.A N ASP 99.A OD2 no hydrogen 2.839 N/A ASP 99.A N SER 96.A OG no hydrogen 2.974 N/A TRP 100.A N SER 96.A O no hydrogen 3.128 N/A TYR 101.A N ASP 97.A O no hydrogen 2.965 N/A ASN 102.A N ASP 98.A O no hydrogen 2.828 N/A GLU 103.A N ASP 99.A O no hydrogen 2.904 N/A LEU 104.A N TRP 100.A O no hydrogen 2.988 N/A SER 105.A N TYR 101.A O no hydrogen 2.907 N/A SER 105.A OG TYR 101.A O no hydrogen 2.901 N/A LEU 106.A N ASN 102.A O no hydrogen 3.110 N/A ASN 107.A N GLU 103.A O no hydrogen 3.033 N/A ASN 107.A ND2 GLY 84.A O no hydrogen 2.787 N/A ASN 107.A ND2 GLU 103.A O no hydrogen 2.930 N/A LEU 108.A N LEU 104.A O no hydrogen 2.925 N/A PHE 109.A N LEU 104.A O no hydrogen 2.895 N/A VAL 112.A N LEU 108.A O no hydrogen 3.186 N/A ARG 113.A N PHE 109.A O no hydrogen 2.853 N/A LEU 114.A N ALA 110.A O no hydrogen 2.981 N/A ASP 115.A N ALA 111.A O no hydrogen 2.802 N/A ARG 116.A N VAL 112.A O no hydrogen 3.001 N/A GLN 117.A N LEU 114.A O no hydrogen 3.033 N/A LEU 118.A N LEU 114.A O no hydrogen 2.887 N/A VAL 119.A N ASP 115.A O no hydrogen 2.863 N/A ALA 123.A N PRO 120.A O no hydrogen 2.933 N/A ARG 124.A N ASP 121.A O no hydrogen 3.053 N/A ARG 124.A NE SER 126.A O no hydrogen 3.363 N/A ARG 124.A NE SER 126.A OG no hydrogen 3.005 N/A ARG 124.A NH1 VAL 76.A O no hydrogen 3.359 N/A ARG 124.A NH2 VAL 76.A O no hydrogen 2.639 N/A ARG 124.A NH2 SER 126.A O no hydrogen 2.861 N/A VAL 128.A N ASP 77.A O no hydrogen 2.866 N/A VAL 129.A N ARG 171.A O no hydrogen 2.848 N/A VAL 130.A N ILE 79.A O no hydrogen 2.742 N/A HIS 131.A N VAL 173.A O no hydrogen 2.895 N/A HIS 131.A ND1 SER 159.A OG no hydrogen 2.811 N/A HIS 131.A NE2 ASP 115.A OD2 no hydrogen 2.741 N/A VAL 132.A N HIS 81.A O no hydrogen 3.186 N/A THR 133.A N VAL 175.A O no hydrogen 2.826 N/A THR 133.A OG1 VAL 175.A O no hydrogen 3.494 N/A THR 133.A OG1 GLU 243.A OE2 no hydrogen 2.788 N/A ILE 135.A N PRO 177.A O no hydrogen 3.117 N/A GLN 136.A N SER 134.A OG no hydrogen 3.042 N/A GLN 136.A NE2 THR 145.A OG1 no hydrogen 3.084 N/A ARG 137.A N SER 134.A O no hydrogen 2.937 N/A ARG 137.A NE GLU 243.A OE1 no hydrogen 2.848 N/A ARG 137.A NE GLU 243.A OE2 no hydrogen 3.394 N/A ARG 137.A NH2 GLU 243.A OE1 no hydrogen 2.958 N/A VAL 138.A N ILE 135.A O no hydrogen 3.048 N/A LEU 139.A N ILE 135.A O no hydrogen 2.767 N/A LEU 141.A N GLN 136.A OE1 no hydrogen 2.954 N/A THR 145.A OG1 GLN 136.A OE1 no hydrogen 3.136 N/A THR 145.A OG1 LEU 141.A O no hydrogen 2.593 N/A THR 146.A OG1 PRO 142.A O no hydrogen 3.057 N/A ALA 149.A N THR 145.A O no hydrogen 2.877 N/A ALA 150.A N THR 146.A O no hydrogen 3.153 N/A ALA 151.A N ALA 147.A O no hydrogen 2.908 N/A LYS 152.A N TYR 148.A O no hydrogen 3.043 N/A LYS 152.A NZ VAL 132.A O no hydrogen 3.023 N/A LYS 152.A NZ THR 133.A O no hydrogen 2.922 N/A ALA 153.A N ALA 149.A O no hydrogen 2.934 N/A ALA 154.A N ALA 150.A O no hydrogen 2.965 N/A LEU 155.A N ALA 151.A O no hydrogen 2.995 N/A SER 156.A N LYS 152.A O no hydrogen 2.891 N/A SER 156.A OG GLU 243.A OE2 no hydrogen 3.307 N/A THR 157.A N ALA 153.A O no hydrogen 3.056 N/A TYR 158.A N ALA 154.A O no hydrogen 2.873 N/A TYR 158.A OH ASP 115.A OD2 no hydrogen 2.639 N/A SER 159.A N LEU 155.A O no hydrogen 2.839 N/A SER 159.A OG HIS 131.A ND1 no hydrogen 2.811 N/A LYS 160.A N SER 156.A O no hydrogen 3.149 N/A LYS 160.A NZ GLY 241.A O no hydrogen 2.846 N/A ALA 161.A N THR 157.A O no hydrogen 2.904 N/A SER 162.A OG.A SER 166.A OG no hydrogen 2.924 N/A SER 162.A OG.A THR 240.A OG1 no hydrogen 3.193 N/A SER 162.A OG.B LYS 160.A O no hydrogen 2.463 N/A LYS 163.A N LYS 160.A O no hydrogen 3.110 N/A GLU 164.A N ALA 161.A O no hydrogen 3.292 N/A SER 166.A N SER 162.A O no hydrogen 2.881 N/A SER 166.A OG SER 162.A O no hydrogen 2.736 N/A SER 166.A OG SER 162.A OG.A no hydrogen 2.924 N/A SER 166.A OG THR 240.A OG1 no hydrogen 2.713 N/A LYS 168.A N VAL 165.A O no hydrogen 2.872 N/A GLY 169.A N SER 166.A O no hydrogen 3.059 N/A VAL 170.A N VAL 165.A O no hydrogen 3.255 N/A ARG 171.A N GLY 127.A O no hydrogen 2.959 N/A ARG 171.A NH1 LEU 231.A O no hydrogen 3.023 N/A ARG 171.A NH1 ILE 239.A O no hydrogen 2.988 N/A ARG 171.A NH2 LEU 231.A O no hydrogen 2.878 N/A VAL 172.A N THR 240.A OG1 no hydrogen 3.062 N/A VAL 173.A N VAL 129.A O no hydrogen 2.930 N/A ARG 174.A N ALA 242.A O no hydrogen 2.928 N/A ARG 174.A NH1 SER 156.A OG no hydrogen 2.961 N/A ARG 174.A NH2 GLY 241.A O no hydrogen 3.162 N/A VAL 175.A N HIS 131.A O no hydrogen 3.008 N/A SER 176.A N TYR 244.A O no hydrogen 2.923 N/A SER 176.A OG THR 133.A OG1 no hydrogen 3.428 N/A GLY 178.A N ILE 246.A O no hydrogen 2.882 N/A GLU 181.A N ALA 219.A O no hydrogen 2.774 N/A THR 182.A N SER 185.A OG no hydrogen 2.784 N/A THR 182.A OG1 SER 185.A OG no hydrogen 3.429 N/A SER 185.A N THR 182.A OG1 no hydrogen 3.095 N/A SER 185.A OG ILE 180.A O no hydrogen 3.479 N/A SER 185.A OG THR 182.A O no hydrogen 3.025 N/A SER 185.A OG THR 182.A OG1 no hydrogen 3.429 N/A VAL 186.A N THR 182.A O no hydrogen 2.972 N/A ARG 187.A N GLU 183.A O no hydrogen 3.042 N/A ARG 187.A NE GLU 183.A O no hydrogen 3.319 N/A LEU 188.A N ALA 184.A O no hydrogen 2.923 N/A ALA 189.A N SER 185.A O no hydrogen 2.797 N/A GLU 190.A N VAL 186.A O no hydrogen 3.008 N/A ARG 191.A N ARG 187.A O no hydrogen 2.761 N/A LEU 192.A N LEU 188.A O no hydrogen 3.008 N/A ALA 193.A N ARG 191.A O no hydrogen 2.449 N/A LYS 194.A N ARG 191.A O no hydrogen 2.722 N/A GLU 201.A N ASP 199.A O no hydrogen 2.612 N/A GLY 202.A N ASP 199.A OD2 no hydrogen 3.200 N/A LYS 204.A N LEU 200.A O no hydrogen 2.717 N/A LYS 204.A NZ GLU 181.A OE2 no hydrogen 3.121 N/A LYS 205.A N GLU 201.A O no hydrogen 2.955 N/A LYS 205.A NZ ASP 208.A OD2 no hydrogen 2.924 N/A ILE 206.A N GLY 202.A O no hydrogen 3.068 N/A ILE 207.A N GLY 203.A O no hydrogen 3.216 N/A GLY 209.A N ILE 206.A O no hydrogen 3.087 N/A LEU 210.A N ILE 207.A O no hydrogen 3.283 N/A GLY 211.A N ASP 208.A O no hydrogen 2.853 N/A LEU 215.A N GLY 248.A O no hydrogen 2.913 N/A GLY 216.A N ILE 213.A O no hydrogen 2.693 N/A ARG 217.A NH1 PRO 218.A O no hydrogen 3.044 N/A ARG 217.A NH1 GLU 223.A OE1 no hydrogen 2.929 N/A ARG 217.A NH2 GLU 223.A OE2 no hydrogen 2.846 N/A ALA 219.A N TRP 179.A O no hydrogen 2.951 N/A LYS 220.A N GLU 223.A OE1 no hydrogen 2.838 N/A GLU 223.A N LYS 220.A O no hydrogen 2.910 N/A VAL 224.A N LYS 220.A O no hydrogen 3.266 N/A ALA 225.A N PRO 221.A O no hydrogen 3.023 N/A ASN 226.A N GLU 222.A O no hydrogen 2.874 N/A LEU 227.A N GLU 223.A O no hydrogen 3.306 N/A ILE 228.A N VAL 224.A O no hydrogen 3.097 N/A ALA 229.A N ALA 225.A O no hydrogen 2.845 N/A PHE 230.A N ASN 226.A O no hydrogen 3.088 N/A LEU 231.A N LEU 227.A O no hydrogen 2.983 N/A ALA 232.A N ILE 228.A O no hydrogen 2.964 N/A SER 233.A N PHE 230.A O no hydrogen 3.101 N/A SER 233.A OG PHE 230.A O no hydrogen 2.736 N/A ARG 235.A N SER 233.A OG no hydrogen 3.151 N/A ARG 235.A NE PHE 3.A O no hydrogen 2.593 N/A ARG 235.A NH2 PHE 3.A O no hydrogen 3.404 N/A ALA 236.A N SER 233.A O no hydrogen 3.178 N/A ILE 239.A N ALA 236.A O no hydrogen 2.951 N/A THR 240.A OG1 SER 162.A OG.A no hydrogen 3.193 N/A THR 240.A OG1 SER 166.A OG no hydrogen 2.713 N/A GLY 241.A N VAL 172.A O no hydrogen 2.817 N/A TYR 244.A N ARG 174.A O no hydrogen 2.839 N/A ILE 246.A N SER 176.A O no hydrogen 2.905 N/A GLY 249.A N ASP 247.A OD1 no hydrogen 2.889 N/A THR 250.A N ASP 247.A O no hydrogen 3.026 N/A THR 250.A OG1 ASP 247.A O no hydrogen 2.701 N/A VAL 251.A N ASP 247.A OD2 no hydrogen 2.811 N/A