Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p8z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N GLU 6.A OE1 no hydrogen 2.949 N/A THR 3.A OG1 GLU 6.A OE1 no hydrogen 2.904 N/A GLU 6.A N THR 3.A OG1 no hydrogen 3.015 N/A LYS 7.A N THR 3.A O no hydrogen 3.068 N/A TRP 8.A N LEU 4.A O no hydrogen 2.853 N/A TRP 8.A NE1 TYR 23.A OH no hydrogen 2.990 N/A LYS 9.A N GLY 5.A O no hydrogen 2.913 N/A LYS 9.A NZ SER 146.A O no hydrogen 2.755 N/A LYS 9.A NZ GLU 152.A OE2 no hydrogen 3.239 N/A LYS 10.A N GLU 6.A O no hydrogen 3.101 N/A LYS 11.A N LYS 7.A O no hydrogen 3.086 N/A LEU 12.A N TRP 8.A O no hydrogen 2.911 N/A ASN 13.A N LYS 9.A O no hydrogen 3.021 N/A ASN 13.A ND2 PRO 147.A O no hydrogen 2.972 N/A GLN 14.A N LYS 10.A O no hydrogen 3.157 N/A GLN 14.A N LYS 11.A O no hydrogen 3.036 N/A LEU 15.A N LYS 11.A O no hydrogen 3.292 N/A LEU 15.A N LEU 12.A O no hydrogen 3.244 N/A SER 16.A N GLU 19.A OE1 no hydrogen 3.021 N/A GLU 19.A N SER 16.A OG no hydrogen 3.059 N/A PHE 20.A N SER 16.A O no hydrogen 2.773 N/A ASP 21.A N ARG 17.A O no hydrogen 2.922 N/A LEU 22.A N LYS 18.A O no hydrogen 3.211 N/A TYR 23.A N GLU 19.A O no hydrogen 2.886 N/A TYR 23.A OH LEU 233.A O no hydrogen 2.715 N/A LYS 24.A N PHE 20.A O no hydrogen 2.867 N/A LYS 24.A NZ ASP 21.A OD2 no hydrogen 2.658 N/A LYS 25.A NZ GLU 30.A OE2 no hydrogen 3.153 N/A SER 26.A N TYR 23.A O no hydrogen 3.044 N/A GLY 27.A N ARG 242.A O no hydrogen 2.749 N/A ILE 28.A N LYS 25.A O no hydrogen 3.238 N/A THR 29.A N PRO 203.A O no hydrogen 3.063 N/A GLU 30.A N THR 245.A O no hydrogen 2.882 N/A ASP 32.A N GLU 247.A O no hydrogen 2.804 N/A ARG 33.A NH1 ALA 49.A O no hydrogen 2.874 N/A ARG 33.A NH1 ASP 249.A OD2 no hydrogen 2.721 N/A ARG 33.A NH2 ALA 49.A O no hydrogen 2.994 N/A THR 34.A N ASP 32.A OD1 no hydrogen 3.087 N/A THR 34.A OG1 ASP 32.A OD1 no hydrogen 2.861 N/A LYS 37.A N ARG 33.A O no hydrogen 2.808 N/A GLU 38.A N THR 34.A O no hydrogen 3.000 N/A GLY 39.A N GLU 35.A O no hydrogen 2.907 N/A LEU 40.A N ALA 36.A O no hydrogen 2.827 N/A LYS 41.A N LYS 37.A O no hydrogen 2.831 N/A ARG 42.A N GLU 38.A O no hydrogen 3.276 N/A ARG 42.A N GLY 39.A O no hydrogen 2.986 N/A GLY 43.A N LEU 40.A O no hydrogen 3.102 N/A GLU 44.A N GLY 39.A O no hydrogen 2.979 N/A THR 45.A OG1 SER 112.A OG no hydrogen 2.635 N/A HIS 47.A N GLY 253.A O no hydrogen 2.779 N/A HIS 47.A ND1 ASP 251.A OD1 no hydrogen 2.975 N/A HIS 48.A N THR 46.A O no hydrogen 2.762 N/A HIS 48.A NE2 GLU 44.A OE2 no hydrogen 2.769 N/A ARG 52.A NH2 VAL 31.A O no hydrogen 2.858 N/A GLY 53.A N SER 51.A OG no hydrogen 2.988 N/A SER 54.A OG GLY 81.A O no hydrogen 2.763 N/A LYS 56.A N ARG 52.A O no hydrogen 3.150 N/A LYS 56.A NZ GLU 211.A OE1 no hydrogen 2.564 N/A LYS 56.A NZ TYR 213.A OH no hydrogen 2.973 N/A LEU 57.A N GLY 53.A O no hydrogen 2.900 N/A GLN 58.A N SER 54.A O no hydrogen 2.937 N/A TRP 59.A N ALA 55.A O no hydrogen 3.042 N/A VAL 61.A N LEU 57.A O no hydrogen 3.036 N/A GLU 62.A N GLN 58.A O no hydrogen 2.828 N/A ARG 63.A NH1 TRP 59.A O no hydrogen 2.968 N/A ASN 64.A N VAL 61.A O no hydrogen 2.868 N/A MET 65.A N PHE 60.A O no hydrogen 2.978 N/A ILE 67.A N GLN 171.A OE1 no hydrogen 2.687 N/A GLU 69.A N THR 137.A OG1 no hydrogen 2.871 N/A GLY 70.A N LYS 91.A O no hydrogen 2.742 N/A ARG 71.A N ASP 136.A OD2 no hydrogen 2.606 N/A ARG 71.A NE GLU 94.A OE2 no hydrogen 3.203 N/A ARG 71.A NH1 GLU 133.A OE1 no hydrogen 2.940 N/A ARG 71.A NH1 LYS 134.A O no hydrogen 2.773 N/A ARG 71.A NH2 GLU 133.A OE1 no hydrogen 2.877 N/A VAL 72.A N GLU 94.A O no hydrogen 2.803 N/A ILE 73.A N THR 137.A O no hydrogen 2.771 N/A ASP 74.A N ARG 96.A O no hydrogen 2.790 N/A LEU 75.A N LEU 139.A O no hydrogen 2.883 N/A CYS 77.A N TYR 98.A O no hydrogen 2.968 N/A CYS 77.A SG GLY 78.A O no hydrogen 3.719 N/A GLY 78.A N THR 99.A OG1 no hydrogen 2.962 N/A ARG 79.A NE.A VAL 50.A O no hydrogen 2.846 N/A ARG 79.A NH1.A VAL 50.A O no hydrogen 2.813 N/A ARG 79.A NH2.B VAL 50.A O no hydrogen 3.280 N/A SER 83.A OG ASP 74.A OD2 no hydrogen 2.759 N/A TYR 84.A N GLY 80.A O no hydrogen 2.862 N/A TYR 84.A OH VAL 109.A O no hydrogen 2.502 N/A TYR 85.A N GLY 81.A O no hydrogen 3.250 N/A CYS 86.A N TRP 82.A O no hydrogen 2.984 N/A CYS 86.A SG TRP 82.A O no hydrogen 3.474 N/A ALA 87.A N SER 83.A O no hydrogen 2.990 N/A ALA 87.A N TYR 84.A O no hydrogen 3.252 N/A GLY 88.A N TYR 85.A O no hydrogen 3.173 N/A LEU 89.A N CYS 86.A O no hydrogen 3.129 N/A VAL 92.A N LEU 89.A O no hydrogen 3.091 N/A THR 93.A N GLY 70.A O no hydrogen 2.793 N/A GLU 94.A N GLY 70.A O no hydrogen 3.075 N/A VAL 95.A N ILE 118.A O no hydrogen 2.424 N/A ARG 96.A N VAL 72.A O no hydrogen 2.859 N/A ARG 96.A NH1.B TYR 98.A OH no hydrogen 3.108 N/A ARG 96.A NH2.A TYR 98.A OH no hydrogen 2.666 N/A GLY 97.A N LYS 120.A O no hydrogen 2.829 N/A TYR 98.A N ASP 74.A O no hydrogen 3.018 N/A TYR 98.A OH GLU 133.A OE1 no hydrogen 3.286 N/A TYR 98.A OH GLU 133.A OE2 no hydrogen 2.421 N/A THR 99.A N MET 122.A O no hydrogen 2.894 N/A GLY 102.A N GLU 107.A OE2 no hydrogen 2.783 N/A HIS 105.A N GLY 102.A O no hydrogen 3.036 N/A VAL 109.A N ARG 79.A O no hydrogen 3.001 N/A SER 112.A N THR 45.A O no hydrogen 2.743 N/A SER 112.A OG THR 45.A OG1 no hydrogen 2.635 N/A TYR 114.A N LEU 252.A O no hydrogen 3.007 N/A GLY 115.A N GLY 255.A O no hydrogen 2.980 N/A TRP 116.A N THR 113.A O no hydrogen 3.328 N/A ILE 118.A N GLY 115.A O no hydrogen 3.163 N/A LYS 120.A N VAL 95.A O no hydrogen 2.811 N/A MET 122.A N GLY 97.A O no hydrogen 2.733 N/A SER 123.A OG GLU 107.A OE1 no hydrogen 2.647 N/A GLY 124.A N LYS 100.A O no hydrogen 3.016 N/A LYS 125.A N THR 99.A O no hydrogen 3.006 N/A PHE 128.A N ASP 126.A OD1 no hydrogen 3.023 N/A TYR 129.A N ASP 126.A O no hydrogen 3.018 N/A LEU 130.A N VAL 127.A O no hydrogen 3.180 N/A CYS 135.A SG GLU 133.A O no hydrogen 3.845 N/A CYS 135.A SG TRP 166.A O no hydrogen 3.836 N/A ASP 136.A N ARG 71.A O no hydrogen 2.685 N/A THR 137.A N ARG 71.A O no hydrogen 2.983 N/A THR 137.A OG1 GLU 69.A O no hydrogen 2.954 N/A LEU 138.A N GLN 171.A O no hydrogen 2.870 N/A LEU 139.A N ILE 73.A O no hydrogen 2.785 N/A CYS 140.A N CYS 173.A O no hydrogen 2.940 N/A CYS 140.A SG LEU 75.A O no hydrogen 3.932 N/A ASP 141.A N LEU 75.A O no hydrogen 3.126 N/A SER 146.A N GLU 152.A OE2 no hydrogen 2.841 N/A SER 148.A N SER 146.A OG no hydrogen 3.020 N/A THR 150.A OG1 SER 148.A OG no hydrogen 3.114 N/A VAL 151.A N SER 148.A OG no hydrogen 2.932 N/A GLU 152.A N SER 148.A O no hydrogen 3.029 N/A GLU 153.A N PRO 149.A O no hydrogen 2.822 N/A SER 154.A N THR 150.A O no hydrogen 3.088 N/A ARG 155.A N VAL 151.A O no hydrogen 2.997 N/A ARG 155.A NH2 GLU 144.A O no hydrogen 2.835 N/A ARG 155.A NH2 SER 145.A O no hydrogen 3.458 N/A THR 156.A N GLU 152.A O no hydrogen 2.852 N/A THR 156.A OG1 GLU 152.A O no hydrogen 2.810 N/A ILE 157.A N GLU 153.A O no hydrogen 2.899 N/A ARG 158.A N SER 154.A O no hydrogen 2.974 N/A VAL 159.A N ARG 155.A O no hydrogen 3.057 N/A LEU 160.A N THR 156.A O no hydrogen 2.926 N/A LYS 161.A N ILE 157.A O no hydrogen 2.911 N/A MET 162.A N ARG 158.A O no hydrogen 2.894 N/A VAL 163.A N VAL 159.A O no hydrogen 2.894 N/A GLU 164.A N LEU 160.A O no hydrogen 3.364 N/A TRP 166.A N VAL 163.A O no hydrogen 2.833 N/A LEU 167.A N GLU 164.A O no hydrogen 2.938 N/A LYS 168.A N ASN 170.A OD1 no hydrogen 2.915 N/A ASN 170.A ND2 CYS 135.A O no hydrogen 3.101 N/A ASN 170.A ND2 TRP 166.A O no hydrogen 3.067 N/A GLN 171.A N ASP 136.A O no hydrogen 3.191 N/A GLN 171.A NE2 ASN 217.A OD1 no hydrogen 3.078 N/A PHE 172.A N SER 216.A OG no hydrogen 3.006 N/A CYS 173.A N LEU 138.A O no hydrogen 3.159 N/A ILE 174.A N TRP 214.A O no hydrogen 2.880 N/A LYS 175.A N CYS 140.A O no hydrogen 2.801 N/A LYS 175.A NZ ASP 141.A O no hydrogen 3.239 N/A LYS 175.A NZ GLY 143.A O no hydrogen 2.804 N/A VAL 176.A N MET 212.A O no hydrogen 2.746 N/A ASN 178.A N THR 156.A OG1 no hydrogen 3.004 N/A ASN 178.A ND2 GLU 152.A OE1 no hydrogen 3.126 N/A TYR 180.A N ASN 178.A OD1 no hydrogen 3.209 N/A MET 181.A N ASN 178.A OD1 no hydrogen 3.314 N/A THR 183.A OG1 GLU 153.A OE2 no hydrogen 2.245 N/A ILE 185.A N MET 181.A O no hydrogen 3.145 N/A GLU 186.A N PRO 182.A O no hydrogen 3.136 N/A HIS 187.A N THR 183.A O no hydrogen 3.223 N/A LEU 188.A N VAL 184.A O no hydrogen 2.857 N/A GLU 189.A N ILE 185.A O no hydrogen 2.862 N/A ARG 190.A N GLU 186.A O no hydrogen 3.000 N/A ARG 190.A NH1 GLU 164.A OE2 no hydrogen 2.968 N/A ARG 190.A NH2 HIS 187.A ND1 no hydrogen 3.067 N/A LEU 191.A N HIS 187.A O no hydrogen 2.850 N/A GLN 192.A N LEU 188.A O no hydrogen 2.809 N/A GLN 192.A NE2 GLY 197.A O no hydrogen 3.173 N/A GLN 192.A NE2 GLY 220.A O no hydrogen 2.921 N/A ARG 193.A N GLU 189.A O no hydrogen 3.135 N/A LYS 194.A N ARG 190.A O no hydrogen 3.230 N/A HIS 195.A N LEU 191.A O no hydrogen 2.828 N/A HIS 195.A NE2 GLU 164.A OE1 no hydrogen 3.044 N/A GLY 196.A N GLN 192.A O no hydrogen 2.656 N/A MET 198.A N ILE 215.A O no hydrogen 2.929 N/A VAL 200.A N TYR 213.A O no hydrogen 2.778 N/A ARG 201.A NH1 THR 209.A O no hydrogen 2.889 N/A ARG 201.A NH1 GLU 211.A O no hydrogen 2.850 N/A ARG 201.A NH2 ARG 206.A O no hydrogen 2.938 N/A ARG 201.A NH2 THR 209.A O no hydrogen 3.081 N/A ASN 202.A ND2 LYS 56.A O no hydrogen 2.984 N/A LEU 204.A N ASN 202.A OD1 no hydrogen 2.902 N/A SER 205.A N ASN 202.A O no hydrogen 3.083 N/A SER 205.A OG ASN 202.A O no hydrogen 3.510 N/A SER 205.A OG GLU 211.A OE1 no hydrogen 2.574 N/A ASN 207.A N LYS 24.A O no hydrogen 2.796 N/A ASN 207.A ND2 TYR 23.A O no hydrogen 2.829 N/A ASN 207.A ND2 SER 26.A O no hydrogen 2.721 N/A THR 209.A N ARG 206.A O no hydrogen 3.290 N/A HIS 210.A ND1 HIS 210.A O no hydrogen 2.713 N/A HIS 210.A NE2 SER 230.A OG no hydrogen 2.738 N/A GLU 211.A N THR 209.A OG1 no hydrogen 3.025 N/A MET 212.A N VAL 176.A O no hydrogen 3.128 N/A TYR 213.A N VAL 200.A O no hydrogen 2.820 N/A TYR 213.A OH ASP 141.A OD1 no hydrogen 2.681 N/A TRP 214.A N ILE 174.A O no hydrogen 2.783 N/A TRP 214.A NE1 GLY 196.A O no hydrogen 2.904 N/A ILE 215.A N MET 198.A O no hydrogen 2.939 N/A SER 216.A N PHE 172.A O no hydrogen 3.021 N/A SER 216.A OG GLN 171.A OE1 no hydrogen 3.435 N/A SER 216.A OG PHE 172.A O no hydrogen 3.469 N/A SER 216.A OG ASN 217.A OD1 no hydrogen 3.041 N/A ASN 217.A N MET 65.A O no hydrogen 2.913 N/A ASN 217.A ND2 ASN 64.A O no hydrogen 3.301 N/A ASN 217.A ND2 GLN 171.A OE1 no hydrogen 2.743 N/A SER 224.A N ASN 221.A OD1 no hydrogen 2.868 N/A SER 225.A N ASN 221.A O no hydrogen 3.130 N/A SER 225.A OG ASN 221.A O no hydrogen 3.536 N/A SER 225.A OG ILE 222.A O no hydrogen 2.696 N/A VAL 226.A N ILE 222.A O no hydrogen 2.943 N/A ASN 227.A N VAL 223.A O no hydrogen 3.044 N/A MET 228.A N SER 224.A O no hydrogen 2.992 N/A VAL 229.A N SER 225.A O no hydrogen 3.157 N/A SER 230.A N VAL 226.A O no hydrogen 2.917 N/A SER 230.A OG HIS 210.A NE2 no hydrogen 2.738 N/A SER 230.A OG VAL 226.A O no hydrogen 3.291 N/A ARG 231.A N ASN 227.A O no hydrogen 2.871 N/A LEU 232.A N MET 228.A O no hydrogen 3.016 N/A LEU 233.A N VAL 229.A O no hydrogen 2.922 N/A LEU 234.A N SER 230.A O no hydrogen 2.979 N/A ASN 235.A N ARG 231.A O no hydrogen 2.809 N/A ARG 236.A N LEU 232.A O no hydrogen 3.026 N/A ARG 236.A NH2 ASN 207.A OD1 no hydrogen 2.901 N/A PHE 237.A N LEU 234.A O no hydrogen 3.051 N/A THR 238.A N ASN 235.A O no hydrogen 3.084 N/A THR 238.A OG1 ASN 235.A O no hydrogen 2.716 N/A HIS 241.A ND1 LEU 22.A O no hydrogen 2.705 N/A ARG 242.A N SER 26.A OG no hydrogen 2.981 N/A THR 245.A N ILE 28.A O no hydrogen 2.800 N/A GLU 247.A N GLU 30.A O no hydrogen 2.821 N/A VAL 250.A N ASP 249.A OD1 no hydrogen 2.778 N/A LEU 252.A N HIS 47.A O no hydrogen 2.713 N/A GLY 253.A N ASP 251.A OD1 no hydrogen 2.740 N/A ARG 257.A NH1 ALA 87.A O no hydrogen 3.455 N/A