Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4y4h_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASN 23.A O no hydrogen 2.896 N/A THR 4.A OG1 ASN 23.A O no hydrogen 3.311 N/A GLN 5.A NE2 TYR 88.A O no hydrogen 2.840 N/A SER 6.A N SER 21.A O no hydrogen 3.056 N/A ARG 8.A NE GLY 104.A O no hydrogen 2.822 N/A LYS 10.A N ARG 106.A O no hydrogen 2.926 N/A ALA 12.A N LEU 108.A O no hydrogen 2.902 N/A THR 14.A N LEU 110.A O no hydrogen 2.760 N/A THR 14.A OG1 LEU 110.A O no hydrogen 3.099 N/A THR 14.A OG1 GLU 111.A OE1 no hydrogen 3.311 N/A GLY 15.A N ALA 80.A O no hydrogen 2.840 N/A GLY 16.A N VAL 13.A O no hydrogen 2.719 N/A VAL 18.A N LEU 77.A O no hydrogen 2.928 N/A LEU 20.A N LEU 75.A O no hydrogen 2.708 N/A SER 21.A N SER 6.A O no hydrogen 3.082 N/A CYS 22.A N PHE 73.A O no hydrogen 2.874 N/A CYS 22.A SG THR 4.A O no hydrogen 3.858 N/A ASN 23.A N THR 4.A O no hydrogen 2.838 N/A GLN 24.A N GLU 71.A O no hydrogen 2.987 N/A GLN 24.A NE2 HIS 28.A O no hydrogen 3.288 N/A GLN 24.A NE2 GLN 70.A O no hydrogen 3.373 N/A ASN 26.A N GLN 24.A OE1 no hydrogen 2.778 N/A ASN 26.A ND2 ALA 2.A O no hydrogen 3.332 N/A HIS 28.A N GLN 24.A OE1 no hydrogen 2.882 N/A HIS 28.A ND1 SER 92.A OG no hydrogen 2.665 N/A ASN 30.A N GLY 93.A O no hydrogen 3.326 N/A ASN 30.A ND2 GLY 93.A O no hydrogen 3.283 N/A ASN 30.A ND2 ASP 94.A O no hydrogen 3.157 N/A MET 31.A N SER 48.A O no hydrogen 3.016 N/A TYR 32.A N ALA 91.A O no hydrogen 2.831 N/A TRP 33.A N HIS 46.A O no hydrogen 2.771 N/A TYR 34.A N PHE 89.A O no hydrogen 2.729 N/A TYR 34.A OH GLN 99.A OE1 no hydrogen 2.605 N/A ARG 35.A N ARG 43.A O no hydrogen 3.086 N/A ARG 35.A NE ASP 37.A OD2 no hydrogen 2.712 N/A ARG 35.A NE SER 86.A OG no hydrogen 3.353 N/A ARG 35.A NH1 SER 83.A O no hydrogen 3.244 N/A ARG 35.A NH2 ASP 37.A OD1 no hydrogen 3.164 N/A ARG 35.A NH2 SER 83.A O no hydrogen 2.862 N/A GLN 36.A N VAL 87.A O no hydrogen 2.810 N/A ARG 43.A N ARG 35.A O no hydrogen 3.308 N/A ARG 43.A NH2 ASP 37.A OD2 no hydrogen 2.752 N/A ILE 45.A N TRP 33.A O no hydrogen 2.722 N/A HIS 46.A ND1 GLU 55.A O no hydrogen 3.277 N/A HIS 46.A NE2 TYR 63.A O no hydrogen 3.204 N/A TYR 47.A N GLU 55.A O no hydrogen 2.939 N/A SER 48.A N MET 31.A O no hydrogen 2.879 N/A SER 48.A OG GLY 50.A O no hydrogen 3.150 N/A SER 48.A OG SER 53.A O no hydrogen 3.200 N/A GLY 50.A N SER 48.A OG no hydrogen 3.347 N/A GLY 52.A N ARG 67.A O no hydrogen 2.697 N/A GLU 55.A N TYR 47.A O no hydrogen 2.796 N/A GLY 57.A N ILE 45.A O no hydrogen 2.823 N/A ASP 58.A N LEU 44.A O no hydrogen 2.865 N/A ILE 59.A N LEU 44.A O no hydrogen 3.097 N/A TYR 63.A N PRO 60.A O no hydrogen 3.067 N/A TYR 63.A OH TYR 88.A OH no hydrogen 2.543 N/A LYS 64.A N ILE 76.A O no hydrogen 2.946 N/A SER 66.A N SER 74.A O no hydrogen 2.834 N/A ARG 67.A NH1 ASN 29.A O no hydrogen 3.034 N/A ARG 67.A NH1 SER 48.A OG no hydrogen 2.718 N/A ARG 67.A NH2 HIS 28.A O no hydrogen 3.421 N/A ARG 67.A NH2 ASN 29.A O no hydrogen 3.369 N/A ARG 67.A NH2 GLN 70.A O no hydrogen 2.639 N/A GLN 70.A NE2 ASN 27.A OD1 no hydrogen 2.762 N/A GLN 70.A NE2 ASN 29.A OD1 no hydrogen 3.143 N/A ASN 72.A N SER 69.A O no hydrogen 3.385 N/A PHE 73.A N CYS 22.A O no hydrogen 3.040 N/A SER 74.A N SER 66.A O no hydrogen 2.755 N/A SER 74.A OG LEU 20.A O no hydrogen 3.323 N/A LEU 75.A N LEU 20.A O no hydrogen 2.796 N/A ILE 76.A N LYS 64.A O no hydrogen 2.679 N/A LEU 77.A N VAL 18.A O no hydrogen 2.975 N/A ALA 80.A N GLY 16.A O no hydrogen 2.975 N/A THR 81.A N GLN 84.A OE1 no hydrogen 3.062 N/A THR 81.A OG1 GLN 84.A OE1 no hydrogen 3.103 N/A GLN 84.A N THR 81.A O no hydrogen 3.035 N/A GLN 84.A NE2 GLY 62.A O no hydrogen 3.127 N/A THR 85.A N PRO 82.A O no hydrogen 3.050 N/A THR 85.A OG1 PRO 82.A O no hydrogen 2.943 N/A SER 86.A N LEU 107.A O no hydrogen 3.214 N/A SER 86.A OG GLN 36.A O no hydrogen 2.791 N/A SER 86.A OG ASP 37.A OD1 no hydrogen 2.772 N/A SER 86.A OG VAL 87.A O no hydrogen 3.552 N/A TYR 88.A N THR 105.A O no hydrogen 2.791 N/A TYR 88.A OH TYR 63.A OH no hydrogen 2.543 N/A TYR 88.A OH GLN 84.A O no hydrogen 2.733 N/A PHE 89.A N TYR 34.A O no hydrogen 2.902 N/A CYS 90.A SG TYR 32.A O no hydrogen 3.979 N/A CYS 90.A SG ALA 91.A O no hydrogen 3.899 N/A ALA 91.A N TYR 32.A O no hydrogen 2.951 N/A SER 92.A N TYR 100.A O no hydrogen 3.089 N/A SER 92.A OG HIS 28.A ND1 no hydrogen 2.665 N/A GLY 93.A N ASN 30.A O no hydrogen 2.999 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.751 N/A GLY 96.A N ASP 94.A OD1 no hydrogen 3.002 N/A TYR 100.A N SER 92.A O no hydrogen 2.720 N/A GLY 102.A N CYS 90.A O no hydrogen 2.703 N/A GLY 104.A N GLN 5.A OE1 no hydrogen 2.872 N/A THR 105.A N TYR 88.A O no hydrogen 2.971 N/A THR 105.A OG1 PRO 7.A O no hydrogen 2.887 N/A ARG 106.A N ARG 8.A O no hydrogen 3.136 N/A LEU 107.A N SER 86.A O no hydrogen 2.881 N/A LEU 108.A N LYS 10.A O no hydrogen 2.906 N/A VAL 109.A N THR 85.A OG1 no hydrogen 2.995 N/A LEU 110.A N ALA 12.A O no hydrogen 2.848 N/A VAL 116.A N LEU 113.A O no hydrogen 3.330 N/A THR 117.A N TYR 147.A O no hydrogen 2.811 N/A THR 117.A OG1 ASN 115.A O no hydrogen 3.228 N/A LYS 120.A N THR 144.A O no hydrogen 2.940 N/A SER 122.A N LEU 142.A O no hydrogen 2.952 N/A PHE 124.A N VAL 140.A O no hydrogen 2.745 N/A GLU 130.A N SER 127.A OG no hydrogen 3.314 N/A ILE 131.A N SER 127.A O no hydrogen 3.021 N/A SER 132.A N LYS 128.A O no hydrogen 3.071 N/A SER 132.A OG LYS 128.A O no hydrogen 3.395 N/A SER 132.A OG ALA 129.A O no hydrogen 2.697 N/A HIS 133.A N ALA 129.A O no hydrogen 2.791 N/A THR 134.A N GLU 130.A O no hydrogen 2.708 N/A THR 134.A OG1 GLU 130.A O no hydrogen 2.554 N/A GLN 135.A N ILE 131.A O no hydrogen 2.905 N/A GLN 135.A NE2 SER 132.A O no hydrogen 3.223 N/A LYS 136.A N THR 134.A OG1 no hydrogen 3.054 N/A ALA 137.A N VAL 192.A O no hydrogen 2.727 N/A THR 138.A N GLU 130.A OE1 no hydrogen 2.939 N/A THR 138.A OG1 GLU 130.A OE2 no hydrogen 3.086 N/A LEU 139.A N LEU 190.A O no hydrogen 2.701 N/A VAL 140.A N PHE 124.A O no hydrogen 3.153 N/A CYS 141.A N SER 188.A O no hydrogen 2.944 N/A CYS 141.A SG SER 122.A O no hydrogen 3.997 N/A ALA 143.A N LEU 186.A O no hydrogen 2.827 N/A THR 144.A N LYS 120.A O no hydrogen 2.995 N/A THR 144.A OG1 LYS 120.A O no hydrogen 3.131 N/A PHE 146.A N TYR 184.A O no hydrogen 3.155 N/A TYR 147.A N THR 117.A O no hydrogen 2.933 N/A HIS 150.A ND1 ASN 9.A OD1 no hydrogen 2.583 N/A VAL 151.A N ASP 149.A O no hydrogen 3.241 N/A GLU 152.A N GLN 209.A O no hydrogen 3.065 N/A SER 154.A N GLN 207.A O no hydrogen 2.851 N/A SER 154.A OG GLN 207.A O no hydrogen 3.547 N/A TRP 155.A NE1 SER 188.A OG no hydrogen 2.984 N/A TRP 156.A N ARG 205.A O no hydrogen 2.815 N/A TRP 156.A NE1 SER 154.A OG no hydrogen 2.854 N/A VAL 157.A N LYS 160.A O no hydrogen 2.970 N/A ASN 158.A N HIS 203.A O no hydrogen 2.870 N/A ASN 158.A ND2 ASN 202.A OD1 no hydrogen 3.068 N/A LYS 160.A N VAL 157.A O no hydrogen 3.205 N/A VAL 162.A N TRP 155.A O no hydrogen 2.746 N/A CYS 167.A N ARG 189.A O no hydrogen 2.989 N/A THR 168.A OG1 SER 188.A OG no hydrogen 2.826 N/A ASP 169.A N SER 187.A O no hydrogen 3.248 N/A LEU 173.A N SER 185.A O no hydrogen 2.997 N/A GLU 175.A N ARG 183.A O no hydrogen 2.860 N/A GLN 176.A N SER 182.A OG no hydrogen 2.793 N/A LEU 179.A N GLN 176.A O no hydrogen 3.052 N/A SER 182.A OG ARG 183.A O no hydrogen 2.928 N/A TYR 184.A N PHE 146.A O no hydrogen 2.648 N/A SER 185.A N LEU 173.A O no hydrogen 2.944 N/A LEU 186.A N ALA 143.A O no hydrogen 2.870 N/A SER 187.A N ASP 169.A OD2 no hydrogen 3.043 N/A SER 187.A OG ASP 169.A OD1 no hydrogen 3.360 N/A SER 187.A OG ASP 169.A OD2 no hydrogen 2.901 N/A SER 188.A N CYS 141.A O no hydrogen 3.054 N/A SER 188.A OG CYS 167.A O no hydrogen 3.154 N/A SER 188.A OG THR 168.A OG1 no hydrogen 2.826 N/A ARG 189.A N CYS 167.A O no hydrogen 2.984 N/A ARG 189.A NH1 ASP 169.A OD1 no hydrogen 2.916 N/A ARG 189.A NH1 SER 187.A OG no hydrogen 2.872 N/A LEU 190.A N LEU 139.A O no hydrogen 2.957 N/A ARG 191.A N GLY 165.A O no hydrogen 2.804 N/A ARG 191.A NE GLU 130.A OE2 no hydrogen 3.355 N/A ARG 191.A NH1 GLU 130.A OE2 no hydrogen 3.167 N/A VAL 192.A N ALA 137.A O no hydrogen 2.846 N/A ALA 194.A N GLN 135.A O no hydrogen 3.252 N/A TRP 197.A N SER 193.A O no hydrogen 3.056 N/A GLN 198.A N ALA 194.A O no hydrogen 2.807 N/A ARG 201.A N ASN 199.A OD1 no hydrogen 2.729 N/A ASN 202.A N ASN 199.A O no hydrogen 3.111 N/A ASN 202.A ND2 PHE 196.A O no hydrogen 2.833 N/A HIS 203.A N ASN 158.A OD1 no hydrogen 2.710 N/A PHE 204.A N ALA 235.A O no hydrogen 2.827 N/A ARG 205.A N TRP 156.A O no hydrogen 2.992 N/A ARG 205.A NH2 SER 232.A OG no hydrogen 2.836 N/A CYS 206.A N ALA 233.A O no hydrogen 2.958 N/A GLN 207.A N SER 154.A O no hydrogen 2.896 N/A VAL 208.A N VAL 231.A O no hydrogen 2.864 N/A GLN 209.A N GLU 152.A O no hydrogen 2.861 N/A PHE 210.A N GLN 229.A O no hydrogen 2.712 N/A TYR 211.A N HIS 150.A O no hydrogen 3.254 N/A TYR 211.A OH GLU 152.A OE1 no hydrogen 2.664 N/A GLY 212.A N THR 228.A OG1 no hydrogen 3.078 N/A LEU 213.A N PRO 226.A O no hydrogen 3.088 N/A SER 214.A N ASP 217.A OD2 no hydrogen 2.757 N/A SER 214.A OG ASN 216.A OD1 no hydrogen 3.528 N/A ASN 216.A N SER 214.A OG no hydrogen 3.206 N/A TRP 219.A NE1 ARG 223.A O no hydrogen 2.920 N/A GLN 221.A NE2 ARG 114.A O no hydrogen 3.264 N/A ARG 223.A NH1 VAL 116.A O no hydrogen 3.137 N/A ARG 223.A NH2 VAL 116.A O no hydrogen 3.210 N/A LYS 225.A NZ SER 214.A O no hydrogen 3.295 N/A LYS 225.A NZ GLU 215.A O no hydrogen 3.053 N/A LYS 225.A NZ ASP 217.A O no hydrogen 3.432 N/A VAL 227.A N LYS 225.A O no hydrogen 2.823 N/A THR 228.A N LEU 213.A O no hydrogen 3.204 N/A GLN 229.A N PHE 210.A O no hydrogen 3.077 N/A VAL 231.A N VAL 208.A O no hydrogen 2.887 N/A ALA 233.A N CYS 206.A O no hydrogen 3.144 N/A ALA 235.A N PHE 204.A O no hydrogen 2.770 N/A GLY 237.A N ASN 202.A O no hydrogen 2.989 N/A ARG 238.A NE TRP 236.A O no hydrogen 2.952 N/A ARG 238.A NH2 TRP 236.A O no hydrogen 2.688 N/A