Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pji_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 5.A OE2 no hydrogen 2.986 N/A LEU 3.A N GLY 168.A O no hydrogen 3.125 N/A VAL 6.A N GLU 2.A O no hydrogen 3.055 N/A GLU 7.A N LEU 3.A O no hydrogen 2.822 N/A THR 8.A N PRO 4.A O no hydrogen 3.052 N/A THR 8.A OG1 PRO 4.A O no hydrogen 2.775 N/A VAL 9.A N GLU 5.A O no hydrogen 3.081 N/A ARG 10.A N VAL 6.A O no hydrogen 2.843 N/A ARG 10.A NE GLU 7.A OE1 no hydrogen 3.124 N/A ARG 10.A NE GLU 7.A OE2 no hydrogen 3.131 N/A ARG 10.A NH1 GLU 14.A OE1 no hydrogen 2.768 N/A ARG 10.A NH1 ILE 52.A O no hydrogen 2.859 N/A ARG 10.A NH2 GLU 7.A OE1 no hydrogen 3.103 N/A ARG 11.A N GLU 7.A O no hydrogen 2.928 N/A ARG 11.A NE GLU 7.A OE1 no hydrogen 2.814 N/A GLU 12.A N THR 8.A O no hydrogen 3.104 N/A LEU 13.A N VAL 9.A O no hydrogen 2.981 N/A GLU 14.A N ARG 10.A O no hydrogen 2.884 N/A LYS 15.A N ARG 11.A O no hydrogen 3.075 N/A ARG 16.A N GLU 12.A O no hydrogen 3.041 N/A ARG 16.A N LEU 13.A O no hydrogen 3.170 N/A ILE 17.A N LEU 13.A O no hydrogen 2.856 N/A GLY 19.A N ILE 49.A O.A no hydrogen 2.702 N/A GLY 19.A N ILE 49.A O.B no hydrogen 2.706 N/A GLN 20.A N ILE 17.A O no hydrogen 2.996 N/A ILE 22.A N LYS 47.A O no hydrogen 2.776 N/A ILE 23.A N LYS 97.A O no hydrogen 2.738 N/A SER 24.A N LYS 97.A O no hydrogen 3.409 N/A GLU 26.A N THR 95.A O no hydrogen 3.057 N/A THR 28.A N HIS 93.A O no hydrogen 2.889 N/A THR 28.A OG1 ASP 92.A O no hydrogen 2.946 N/A THR 28.A OG1 HIS 93.A O no hydrogen 3.460 N/A TYR 29.A N HIS 93.A O no hydrogen 3.354 N/A MET 32.A N TYR 29.A O no hydrogen 3.370 N/A VAL 33.A N PRO 30.A O no hydrogen 3.141 N/A LEU 34.A N TRP 114.A O no hydrogen 2.840 N/A GLY 36.A N VAL 33.A O no hydrogen 3.040 N/A GLN 39.A N GLN 39.A OE1 no hydrogen 2.593 N/A LEU 40.A N GLY 36.A O no hydrogen 3.111 N/A LYS 41.A N PHE 37.A O no hydrogen 2.778 N/A LYS 41.A NZ ILE 25.A O no hydrogen 2.929 N/A LYS 42.A N GLU 38.A O no hydrogen 3.049 N/A GLU 43.A N GLN 39.A O no hydrogen 3.026 N/A LEU 44.A N LEU 40.A O no hydrogen 2.911 N/A THR 45.A N LYS 41.A O no hydrogen 3.247 N/A THR 45.A OG1 LYS 41.A O no hydrogen 2.543 N/A GLY 46.A N ILE 22.A O no hydrogen 2.790 N/A LYS 47.A N LEU 44.A O no hydrogen 2.967 N/A LYS 47.A NZ GLU 43.A O no hydrogen 2.848 N/A ILE 49.A N.A GLN 20.A O no hydrogen 2.934 N/A ILE 49.A N.B GLN 20.A O no hydrogen 2.935 N/A GLN 50.A N GLU 62.A O no hydrogen 2.745 N/A GLY 51.A N GLU 62.A O no hydrogen 3.324 N/A SER 53.A N ILE 60.A O no hydrogen 2.741 N/A SER 53.A OG GLU 62.A OE2 no hydrogen 2.756 N/A ARG 54.A NE GLU 7.A OE2 no hydrogen 2.809 N/A ARG 54.A NH1 GLY 56.A O no hydrogen 2.964 N/A ARG 54.A NH1 GLU 134.A OE1 no hydrogen 2.858 N/A ARG 54.A NH2 GLU 134.A OE1 no hydrogen 3.278 N/A ARG 55.A N TYR 58.A O no hydrogen 2.936 N/A ARG 55.A NH1 GLY 132.A O no hydrogen 2.881 N/A ARG 55.A NH1 GLU 134.A OE2 no hydrogen 2.860 N/A ARG 55.A NH2 GLY 132.A O no hydrogen 2.860 N/A GLY 56.A N GLU 134.A OE2 no hydrogen 2.798 N/A LYS 57.A NZ GLN 163.A OE1 no hydrogen 3.400 N/A LYS 57.A NZ LEU 169.A O no hydrogen 2.827 N/A TYR 58.A N ARG 55.A O no hydrogen 2.806 N/A LEU 59.A N.A SER 71.A O no hydrogen 2.834 N/A LEU 59.A N.B SER 71.A O no hydrogen 2.848 N/A ILE 60.A N SER 53.A O no hydrogen 2.815 N/A PHE 61.A N LEU 69.A O no hydrogen 2.864 N/A GLU 62.A N GLY 51.A O no hydrogen 2.842 N/A ILE 63.A N PHE 67.A O no hydrogen 3.024 N/A GLY 64.A N THR 48.A O no hydrogen 2.921 N/A PHE 67.A N ILE 63.A O no hydrogen 3.203 N/A ARG 68.A N ILE 117.A O no hydrogen 2.887 N/A ARG 68.A NH1 PHE 67.A O no hydrogen 2.844 N/A LEU 69.A N PHE 61.A O no hydrogen 2.875 N/A ILE 70.A N.A GLU 115.A O no hydrogen 2.758 N/A ILE 70.A N.B GLU 115.A O no hydrogen 2.756 N/A SER 71.A N LEU 59.A O.A no hydrogen 2.859 N/A SER 71.A N LEU 59.A O.B no hydrogen 2.843 N/A SER 71.A OG TYR 79.A OH no hydrogen 2.646 N/A HIS 72.A N THR 113.A O no hydrogen 2.980 N/A ARG 74.A N HIS 72.A ND1 no hydrogen 2.852 N/A GLY 77.A N LEU 73.A O.A no hydrogen 2.927 N/A GLY 77.A N LEU 73.A O.B no hydrogen 2.934 N/A LYS 78.A N ALA 106.A O no hydrogen 2.817 N/A LYS 78.A NZ GLU 76.A O no hydrogen 3.410 N/A TYR 79.A OH SER 71.A OG no hydrogen 2.646 N/A ARG 80.A N ILE 104.A O no hydrogen 3.066 N/A ARG 80.A NH1 ASP 92.A OD1 no hydrogen 2.934 N/A ARG 80.A NH2 ASP 92.A OD2 no hydrogen 2.859 N/A ALA 82.A N GLN 102.A O no hydrogen 2.875 N/A THR 83.A OG1 ASP 85.A OD1 no hydrogen 2.584 N/A ALA 86.A N THR 83.A O no hydrogen 3.098 N/A GLU 89.A N ASP 92.A OD2 no hydrogen 2.844 N/A ASP 92.A N GLU 89.A O no hydrogen 3.086 N/A HIS 93.A N TYR 105.A O no hydrogen 2.799 N/A HIS 93.A NE2 ASP 107.A O no hydrogen 2.653 N/A LEU 94.A N TYR 105.A O no hydrogen 3.383 N/A THR 95.A N GLU 26.A O no hydrogen 3.018 N/A THR 95.A OG1 GLN 102.A OE1 no hydrogen 2.664 N/A THR 95.A OG1 LEU 103.A O no hydrogen 3.381 N/A MET 96.A N LEU 103.A O no hydrogen 2.843 N/A LYS 97.A N SER 24.A O no hydrogen 2.750 N/A LYS 97.A NZ GLU 26.A OE1 no hydrogen 2.951 N/A LYS 97.A NZ GLU 26.A OE2 no hydrogen 3.447 N/A PHE 98.A N GLY 101.A O no hydrogen 2.697 N/A GLN 102.A N ALA 82.A O no hydrogen 2.855 N/A GLN 102.A NE2 THR 83.A O no hydrogen 2.924 N/A LEU 103.A N MET 96.A O no hydrogen 2.849 N/A ILE 104.A N ARG 80.A O no hydrogen 2.913 N/A TYR 105.A N LEU 94.A O no hydrogen 2.881 N/A TYR 105.A OH ASP 107.A OD1 no hydrogen 2.735 N/A ALA 106.A N LYS 78.A O no hydrogen 2.865 N/A ASP 107.A N HIS 91.A O no hydrogen 3.098 N/A LYS 110.A N ASP 107.A O no hydrogen 3.151 N/A GLY 112.A N ASP 107.A OD1 no hydrogen 2.754 N/A THR 113.A N HIS 72.A O no hydrogen 3.006 N/A TRP 114.A N MET 32.A O no hydrogen 3.010 N/A TRP 114.A NE1 TYR 79.A OH no hydrogen 2.888 N/A GLU 115.A N ILE 70.A O.A no hydrogen 2.897 N/A GLU 115.A N ILE 70.A O.B no hydrogen 2.889 N/A LEU 116.A N THR 35.A OG1 no hydrogen 2.882 N/A ILE 117.A N ARG 68.A O no hydrogen 2.925 N/A SER 118.A N GLN 121.A OE1 no hydrogen 2.770 N/A SER 118.A OG ASP 66.A OD2 no hydrogen 2.639 N/A SER 118.A OG ASP 120.A OD1 no hydrogen 3.542 N/A THR 119.A N ASP 66.A O no hydrogen 3.089 N/A THR 119.A OG1 ASP 66.A OD1 no hydrogen 3.029 N/A GLN 121.A N SER 118.A O no hydrogen 2.877 N/A VAL 122.A N THR 119.A O no hydrogen 3.395 N/A TYR 125.A N GLN 121.A O no hydrogen 2.941 N/A TYR 125.A OH GLU 115.A OE1 no hydrogen 2.508 N/A PHE 126.A N VAL 122.A O no hydrogen 3.178 N/A LEU 127.A N LEU 123.A O no hydrogen 3.003 N/A LYS 128.A N PRO 124.A O no hydrogen 2.904 N/A LYS 129.A N TYR 125.A O no hydrogen 3.108 N/A LYS 130.A N LEU 127.A O no hydrogen 2.991 N/A ILE 131.A N PHE 126.A O no hydrogen 3.448 N/A GLY 132.A N GLN 163.A O no hydrogen 2.696 N/A THR 136.A N GLU 134.A O no hydrogen 2.909 N/A THR 136.A OG1 GLU 138.A OE1 no hydrogen 3.511 N/A ASP 139.A N THR 136.A OG1 no hydrogen 3.042 N/A PHE 140.A N THR 136.A O no hydrogen 2.774 N/A LYS 143.A N ASP 141.A OD2 no hydrogen 3.021 N/A LEU 144.A N ASP 141.A OD1 no hydrogen 3.238 N/A PHE 145.A N ASP 141.A O no hydrogen 3.153 N/A ARG 146.A N GLU 142.A O no hydrogen 2.788 N/A GLU 147.A N LYS 143.A O no hydrogen 3.081 N/A LYS 148.A N LEU 144.A O no hydrogen 2.906 N/A LEU 149.A N PHE 145.A O no hydrogen 3.089 N/A ARG 150.A N ARG 146.A O no hydrogen 2.968 N/A ARG 150.A NH1 GLU 147.A OE2 no hydrogen 3.285 N/A LYS 151.A N GLU 147.A O no hydrogen 3.269 N/A SER 152.A N LEU 149.A O no hydrogen 3.300 N/A LYS 154.A N SER 152.A OG no hydrogen 2.942 N/A LYS 154.A NZ GLU 162.A OE1 no hydrogen 2.997 N/A LYS 154.A NZ GLU 162.A OE2 no hydrogen 2.787 N/A ILE 156.A N LYS 187.A O no hydrogen 2.817 N/A LYS 157.A N PRO 185.A O no hydrogen 3.140 N/A LYS 157.A NZ ASN 171.A OD1 no hydrogen 2.647 N/A LYS 157.A NZ ASP 175.A OD1 no hydrogen 2.850 N/A LYS 157.A NZ GLY 257.A O no hydrogen 2.930 N/A LYS 157.A NZ THR 258.A OG1 no hydrogen 2.967 N/A TYR 159.A N LYS 155.A O no hydrogen 3.079 N/A LEU 160.A N ILE 156.A O no hydrogen 2.938 N/A LEU 161.A N LYS 157.A O no hydrogen 3.050 N/A GLU 162.A N TYR 159.A O no hydrogen 3.053 N/A GLN 163.A N LEU 160.A O no hydrogen 3.446 N/A ALA 167.A N PRO 133.A O no hydrogen 2.870 N/A ASN 171.A ND2 GLY 257.A O no hydrogen 2.845 N/A ILE 172.A N GLU 2.A OE2 no hydrogen 3.006 N/A TYR 173.A N GLU 2.A OE1 no hydrogen 2.978 N/A TYR 173.A OH GLU 5.A OE1 no hydrogen 2.599 N/A TYR 173.A OH SER 217.A OG no hydrogen 2.854 N/A VAL 174.A N GLY 170.A O no hydrogen 2.999 N/A ASP 175.A N ASN 171.A O no hydrogen 3.419 N/A GLU 176.A N ILE 172.A O no hydrogen 3.101 N/A VAL 177.A N TYR 173.A O no hydrogen 2.783 N/A LEU 178.A N VAL 174.A O no hydrogen 3.037 N/A TRP 179.A N ASP 175.A O no hydrogen 3.113 N/A LEU 180.A N GLU 176.A O no hydrogen 3.000 N/A ALA 181.A N VAL 177.A O no hydrogen 2.886 N/A LYS 182.A N TRP 179.A O no hydrogen 3.165 N/A ILE 183.A N LEU 178.A O no hydrogen 2.891 N/A GLU 186.A N HIS 184.A ND1 no hydrogen 3.057 N/A LYS 187.A N HIS 184.A O no hydrogen 3.011 N/A THR 189.A N LYS 154.A O no hydrogen 2.923 N/A THR 189.A OG1 LEU 149.A O no hydrogen 2.749 N/A THR 189.A OG1 SER 152.A O no hydrogen 3.164 N/A GLN 191.A N GLU 188.A O no hydrogen 3.013 N/A LEU 192.A N THR 189.A O no hydrogen 3.125 N/A SER 196.A N.A ILE 193.A O no hydrogen 3.086 N/A ILE 197.A N ILE 193.A O no hydrogen 2.967 N/A HIS 198.A N GLU 194.A O no hydrogen 2.918 N/A HIS 198.A ND1 GLU 142.A OE1 no hydrogen 2.787 N/A HIS 198.A ND1 GLU 142.A OE2 no hydrogen 3.224 N/A LEU 199.A N SER 195.A O no hydrogen 3.024 N/A LEU 200.A N SER 196.A O.A no hydrogen 2.872 N/A LEU 200.A N SER 196.A O.B no hydrogen 2.874 N/A HIS 201.A N ILE 197.A O no hydrogen 2.878 N/A HIS 201.A ND1 ASP 202.A OD1 no hydrogen 2.950 N/A HIS 201.A NE2 PHE 140.A O no hydrogen 2.784 N/A ASP 202.A N HIS 198.A O no hydrogen 3.169 N/A SER 203.A N LEU 199.A O no hydrogen 2.926 N/A SER 203.A OG LEU 199.A O no hydrogen 2.596 N/A ILE 204.A N LEU 200.A O no hydrogen 2.944 N/A ILE 205.A N HIS 201.A O no hydrogen 3.377 N/A GLU 206.A N ASP 202.A O no hydrogen 2.811 N/A ILE 207.A N SER 203.A O no hydrogen 2.837 N/A LEU 208.A N ILE 204.A O no hydrogen 3.210 N/A GLN 209.A N ILE 205.A O no hydrogen 2.955 N/A GLN 209.A NE2 PRO 135.A O no hydrogen 3.087 N/A LYS 210.A N GLU 206.A O no hydrogen 2.887 N/A LYS 210.A NZ GLU 230.A OE2 no hydrogen 3.557 N/A ALA 211.A N ILE 207.A O no hydrogen 2.882 N/A ILE 212.A N LEU 208.A O no hydrogen 2.930 N/A LYS 213.A N GLN 209.A O no hydrogen 3.012 N/A LEU 214.A N LYS 210.A O no hydrogen 3.003 N/A GLY 215.A N ILE 212.A O no hydrogen 2.976 N/A GLY 216.A N ALA 211.A O no hydrogen 2.787 N/A SER 217.A N GLU 5.A OE1 no hydrogen 2.788 N/A SER 217.A OG TYR 173.A OH no hydrogen 2.854 N/A SER 218.A OG GLY 222.A O no hydrogen 3.140 N/A LEU 221.A N TYR 79.A O no hydrogen 3.035 N/A GLY 222.A N GLU 12.A OE1 no hydrogen 3.191 N/A GLY 222.A N GLU 12.A OE2 no hydrogen 3.028 N/A SER 223.A OG ALA 220.A O no hydrogen 2.740 N/A GLY 225.A N SER 218.A OG no hydrogen 2.788 N/A LYS 226.A N LEU 214.A O no hydrogen 2.910 N/A MET 227.A N GLY 216.A O no hydrogen 3.096 N/A GLN 228.A NE2 GLY 216.A O no hydrogen 3.669 N/A ASN 229.A N LYS 226.A O no hydrogen 3.292 N/A GLU 230.A N MET 227.A O no hydrogen 2.787 N/A GLN 232.A N GLU 176.A OE1 no hydrogen 2.689 N/A GLN 232.A NE2 GLU 230.A O no hydrogen 3.292 N/A VAL 233.A N GLU 176.A OE2 no hydrogen 2.841 N/A TYR 234.A N GLU 176.A OE2 no hydrogen 2.909 N/A LYS 236.A N VAL 233.A O no hydrogen 2.839 N/A GLY 238.A N ILE 248.A O no hydrogen 2.977 N/A GLU 239.A N LYS 236.A O no hydrogen 2.854 N/A LYS 240.A NZ GLU 247.A OE1 no hydrogen 2.867 N/A CYS 241.A N ALA 246.A O no hydrogen 2.692 N/A SER 242.A OG GLN 232.A OE1 no hydrogen 2.564 N/A ARG 243.A NH1 TRP 179.A O no hydrogen 3.142 N/A ARG 243.A NH1 LEU 180.A O no hydrogen 3.450 N/A ARG 243.A NH2 TRP 179.A O no hydrogen 2.640 N/A GLY 245.A N CYS 241.A O no hydrogen 2.970 N/A ILE 248.A N GLU 239.A O no hydrogen 2.776 N/A GLN 249.A N.A PHE 260.A O no hydrogen 2.955 N/A GLN 249.A N.B PHE 260.A O no hydrogen 2.973 N/A ILE 251.A N THR 258.A O no hydrogen 2.873 N/A VAL 253.A N ARG 256.A O no hydrogen 2.991 N/A ARG 256.A N VAL 253.A O no hydrogen 2.936 N/A THR 258.A N ILE 251.A O no hydrogen 2.794 N/A THR 258.A OG1 ARG 256.A O no hydrogen 2.984 N/A HIS 259.A N ASP 175.A OD2 no hydrogen 2.815 N/A HIS 259.A ND1 ASP 175.A OD2 no hydrogen 2.979 N/A PHE 260.A N GLN 249.A O.A no hydrogen 3.113 N/A PHE 260.A N GLN 249.A O.B no hydrogen 3.109 N/A CYS 261.A N GLN 265.A OE1 no hydrogen 2.898 N/A GLN 265.A N CYS 261.A O no hydrogen 2.903 N/A GLN 265.A NE2 ILE 183.A O no hydrogen 2.825 N/A GLN 266.A NE2 VAL 263.A O no hydrogen 2.880 N/A LYS 267.A NZ GLU 186.A OE1 no hydrogen 3.436 N/A