Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nnj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N.B ARG 74.A O no hydrogen 2.971 N/A GLU 2.A N GLU 5.A OE2 no hydrogen 2.928 N/A LEU 3.A N GLY 168.A O no hydrogen 3.104 N/A VAL 6.A N GLU 2.A O no hydrogen 3.083 N/A GLU 7.A N LEU 3.A O no hydrogen 2.847 N/A THR 8.A N PRO 4.A O no hydrogen 3.057 N/A THR 8.A OG1 PRO 4.A O no hydrogen 2.765 N/A VAL 9.A N GLU 5.A O no hydrogen 3.061 N/A ARG 10.A N VAL 6.A O no hydrogen 2.844 N/A ARG 10.A NE GLU 7.A OE1 no hydrogen 3.140 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 2.747 N/A ARG 10.A NH1 ILE 52.A O no hydrogen 2.971 N/A ARG 10.A NH2 GLU 7.A OE1 no hydrogen 3.051 N/A ARG 11.A N GLU 7.A O no hydrogen 2.905 N/A ARG 11.A NE GLU 7.A OE1 no hydrogen 2.779 N/A GLU 12.A N THR 8.A O no hydrogen 3.095 N/A LEU 13.A N VAL 9.A O no hydrogen 2.942 N/A GLU 14.A N ARG 10.A O no hydrogen 2.874 N/A LYS 15.A N ARG 11.A O no hydrogen 3.108 N/A ARG 16.A N GLU 12.A O no hydrogen 3.057 N/A ARG 16.A N LEU 13.A O no hydrogen 3.173 N/A ILE 17.A N LEU 13.A O no hydrogen 2.818 N/A GLY 19.A N ILE 49.A O no hydrogen 2.733 N/A GLN 20.A N ILE 17.A O no hydrogen 3.029 N/A GLN 20.A NE2 ASP 100.A OD1 no hydrogen 3.331 N/A ILE 22.A N LYS 47.A O no hydrogen 2.779 N/A ILE 23.A N LYS 97.A O no hydrogen 2.717 N/A SER 24.A N LYS 97.A O no hydrogen 3.406 N/A GLU 26.A N THR 95.A O no hydrogen 2.999 N/A THR 28.A N HIS 93.A O no hydrogen 2.881 N/A THR 28.A OG1 ASP 92.A O no hydrogen 2.969 N/A THR 28.A OG1 HIS 93.A O no hydrogen 3.471 N/A TYR 29.A N HIS 93.A O no hydrogen 3.343 N/A MET 32.A N TYR 29.A O no hydrogen 3.429 N/A VAL 33.A N PRO 30.A O no hydrogen 3.087 N/A LEU 34.A N TRP 114.A O no hydrogen 2.851 N/A GLY 36.A N VAL 33.A O no hydrogen 3.008 N/A GLN 39.A N GLN 39.A OE1 no hydrogen 2.703 N/A LEU 40.A N GLY 36.A O no hydrogen 3.099 N/A LYS 41.A N PHE 37.A O no hydrogen 2.776 N/A LYS 41.A NZ ILE 25.A O no hydrogen 2.801 N/A LYS 42.A N GLU 38.A O no hydrogen 3.004 N/A GLU 43.A N GLN 39.A O no hydrogen 2.988 N/A LEU 44.A N LEU 40.A O no hydrogen 2.884 N/A THR 45.A N LYS 41.A O no hydrogen 3.207 N/A THR 45.A OG1 LYS 41.A O no hydrogen 2.595 N/A GLY 46.A N ILE 22.A O no hydrogen 2.761 N/A LYS 47.A N LEU 44.A O no hydrogen 2.980 N/A LYS 47.A NZ GLU 43.A O no hydrogen 2.967 N/A ILE 49.A N GLN 20.A O no hydrogen 2.999 N/A GLN 50.A N GLU 62.A O no hydrogen 2.726 N/A GLN 50.A NE2 THR 48.A O no hydrogen 2.944 N/A GLY 51.A N GLU 62.A O no hydrogen 3.370 N/A SER 53.A N ILE 60.A O no hydrogen 2.738 N/A SER 53.A OG GLU 62.A OE2 no hydrogen 2.699 N/A ARG 54.A NE GLU 7.A OE2 no hydrogen 2.797 N/A ARG 54.A NH1 GLY 56.A O no hydrogen 3.017 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 3.299 N/A ARG 55.A N TYR 58.A O no hydrogen 2.942 N/A ARG 55.A NH1 GLY 132.A O no hydrogen 2.944 N/A ARG 55.A NH1 GLU 134.A OE2 no hydrogen 2.824 N/A ARG 55.A NH2 GLY 132.A O no hydrogen 2.835 N/A GLY 56.A N GLU 134.A OE2 no hydrogen 2.770 N/A LYS 57.A NZ GLN 163.A OE1 no hydrogen 3.382 N/A LYS 57.A NZ LEU 169.A O no hydrogen 2.786 N/A TYR 58.A N ARG 55.A O no hydrogen 2.839 N/A LEU 59.A N SER 71.A O no hydrogen 2.820 N/A ILE 60.A N SER 53.A O no hydrogen 2.825 N/A PHE 61.A N LEU 69.A O no hydrogen 2.842 N/A GLU 62.A N GLY 51.A O no hydrogen 2.877 N/A ILE 63.A N PHE 67.A O no hydrogen 3.073 N/A GLY 64.A N THR 48.A O no hydrogen 3.005 N/A PHE 67.A N ILE 63.A O no hydrogen 3.186 N/A ARG 68.A N ILE 117.A O no hydrogen 2.821 N/A ARG 68.A NH1 PHE 67.A O no hydrogen 2.820 N/A LEU 69.A N PHE 61.A O no hydrogen 2.898 N/A ILE 70.A N GLU 115.A O no hydrogen 2.798 N/A SER 71.A N LEU 59.A O no hydrogen 2.835 N/A SER 71.A OG TYR 79.A OH no hydrogen 2.577 N/A HIS 72.A N THR 113.A O no hydrogen 3.048 N/A ARG 74.A N HIS 72.A ND1 no hydrogen 2.894 N/A GLY 77.A N LEU 73.A O no hydrogen 2.888 N/A LYS 78.A N ALA 106.A O no hydrogen 2.798 N/A LYS 78.A NZ GLU 76.A O no hydrogen 3.277 N/A LYS 78.A NZ GLU 76.A OE1 no hydrogen 3.433 N/A TYR 79.A OH SER 71.A OG no hydrogen 2.577 N/A ARG 80.A N ILE 104.A O no hydrogen 3.058 N/A ARG 80.A NH1 ASP 92.A OD1 no hydrogen 2.902 N/A ARG 80.A NH2 ASP 92.A OD2 no hydrogen 2.866 N/A ALA 82.A N GLN 102.A O no hydrogen 2.893 N/A THR 83.A OG1 ASP 85.A OD1 no hydrogen 2.630 N/A ALA 86.A N THR 83.A O no hydrogen 3.089 N/A GLU 89.A N ASP 92.A OD2 no hydrogen 2.868 N/A ASP 92.A N GLU 89.A O no hydrogen 3.142 N/A HIS 93.A N TYR 105.A O no hydrogen 2.798 N/A HIS 93.A NE2 ASP 107.A O no hydrogen 2.701 N/A LEU 94.A N TYR 105.A O no hydrogen 3.400 N/A THR 95.A N GLU 26.A O no hydrogen 2.983 N/A THR 95.A OG1 GLN 102.A OE1 no hydrogen 2.657 N/A THR 95.A OG1 LEU 103.A O no hydrogen 3.500 N/A MET 96.A N LEU 103.A O no hydrogen 2.884 N/A LYS 97.A N SER 24.A O no hydrogen 2.727 N/A LYS 97.A NZ GLU 26.A OE2 no hydrogen 2.929 N/A LYS 97.A NZ GLN 102.A OE1 no hydrogen 3.566 N/A PHE 98.A N GLY 101.A O no hydrogen 2.736 N/A GLN 102.A N ALA 82.A O no hydrogen 2.870 N/A GLN 102.A NE2 THR 83.A O no hydrogen 2.897 N/A LEU 103.A N MET 96.A O no hydrogen 2.873 N/A ILE 104.A N ARG 80.A O no hydrogen 2.907 N/A TYR 105.A N LEU 94.A O no hydrogen 2.856 N/A TYR 105.A OH ASP 107.A OD1 no hydrogen 2.799 N/A ALA 106.A N LYS 78.A O no hydrogen 2.847 N/A ASP 107.A N HIS 91.A O no hydrogen 3.081 N/A LYS 110.A N ASP 107.A O no hydrogen 3.129 N/A GLY 112.A N ASP 107.A OD1 no hydrogen 2.751 N/A THR 113.A N HIS 72.A O no hydrogen 3.029 N/A TRP 114.A N MET 32.A O no hydrogen 3.005 N/A TRP 114.A NE1 TYR 79.A OH no hydrogen 2.918 N/A GLU 115.A N ILE 70.A O no hydrogen 2.961 N/A LEU 116.A N THR 35.A OG1 no hydrogen 2.890 N/A ILE 117.A N ARG 68.A O no hydrogen 2.972 N/A SER 118.A N GLN 121.A OE1 no hydrogen 2.908 N/A SER 118.A OG ASP 120.A OD2 no hydrogen 2.665 N/A THR 119.A N ASP 66.A O no hydrogen 3.000 N/A GLN 121.A N SER 118.A O no hydrogen 2.890 N/A VAL 122.A N THR 119.A O no hydrogen 3.461 N/A TYR 125.A N GLN 121.A O no hydrogen 2.891 N/A TYR 125.A OH GLU 115.A OE1 no hydrogen 2.494 N/A PHE 126.A N VAL 122.A O no hydrogen 3.133 N/A LEU 127.A N LEU 123.A O no hydrogen 3.056 N/A LYS 128.A N PRO 124.A O no hydrogen 2.925 N/A LYS 129.A N TYR 125.A O no hydrogen 3.213 N/A LYS 130.A N LEU 127.A O no hydrogen 2.924 N/A ILE 131.A N PHE 126.A O no hydrogen 3.451 N/A GLY 132.A N GLN 163.A O no hydrogen 2.708 N/A THR 136.A N GLU 134.A O no hydrogen 2.908 N/A THR 136.A OG1 GLU 138.A OE1 no hydrogen 3.492 N/A TYR 137.A OH GLU 206.A OE2 no hydrogen 2.861 N/A ASP 139.A N THR 136.A OG1 no hydrogen 3.097 N/A PHE 140.A N THR 136.A O no hydrogen 2.810 N/A LYS 143.A N ASP 141.A OD2 no hydrogen 2.908 N/A LEU 144.A N ASP 141.A OD1 no hydrogen 3.160 N/A PHE 145.A N ASP 141.A O no hydrogen 3.188 N/A ARG 146.A N GLU 142.A O no hydrogen 2.867 N/A GLU 147.A N LYS 143.A O no hydrogen 3.111 N/A LYS 148.A N LEU 144.A O no hydrogen 2.937 N/A LEU 149.A N PHE 145.A O no hydrogen 3.070 N/A ARG 150.A N ARG 146.A O no hydrogen 3.006 N/A LYS 151.A N GLU 147.A O no hydrogen 3.273 N/A SER 152.A N LEU 149.A O no hydrogen 3.387 N/A LYS 154.A N SER 152.A OG no hydrogen 2.991 N/A LYS 154.A NZ GLU 162.A OE1 no hydrogen 3.256 N/A LYS 154.A NZ GLU 162.A OE2 no hydrogen 2.838 N/A ILE 156.A N LYS 187.A O no hydrogen 2.812 N/A LYS 157.A N PRO 185.A O no hydrogen 3.157 N/A LYS 157.A NZ ASN 171.A OD1 no hydrogen 2.629 N/A LYS 157.A NZ ASP 175.A OD1 no hydrogen 2.870 N/A LYS 157.A NZ GLY 257.A O no hydrogen 2.866 N/A LYS 157.A NZ THR 258.A OG1 no hydrogen 2.965 N/A TYR 159.A N LYS 155.A O no hydrogen 3.094 N/A LEU 160.A N ILE 156.A O no hydrogen 2.947 N/A LEU 161.A N LYS 157.A O no hydrogen 3.047 N/A GLU 162.A N TYR 159.A O no hydrogen 3.062 N/A GLN 163.A N LEU 160.A O no hydrogen 3.518 N/A THR 164.A OG1 GLU 162.A OE1 no hydrogen 3.533 N/A ALA 167.A N PRO 133.A O no hydrogen 2.859 N/A ASN 171.A ND2 GLY 257.A O no hydrogen 2.896 N/A ILE 172.A N GLU 2.A OE2 no hydrogen 3.001 N/A TYR 173.A N GLU 2.A OE1 no hydrogen 2.943 N/A TYR 173.A OH GLU 5.A OE1 no hydrogen 2.629 N/A TYR 173.A OH SER 217.A OG no hydrogen 2.814 N/A VAL 174.A N GLY 170.A O no hydrogen 2.981 N/A ASP 175.A N ASN 171.A O no hydrogen 3.337 N/A GLU 176.A N ILE 172.A O no hydrogen 3.115 N/A VAL 177.A N TYR 173.A O no hydrogen 2.806 N/A LEU 178.A N VAL 174.A O no hydrogen 3.047 N/A TRP 179.A N ASP 175.A O no hydrogen 3.160 N/A LEU 180.A N GLU 176.A O no hydrogen 2.997 N/A ALA 181.A N VAL 177.A O no hydrogen 2.904 N/A LYS 182.A N TRP 179.A O no hydrogen 3.252 N/A ILE 183.A N LEU 178.A O no hydrogen 2.941 N/A GLU 186.A N HIS 184.A ND1 no hydrogen 2.962 N/A LYS 187.A N HIS 184.A O no hydrogen 3.036 N/A THR 189.A N LYS 154.A O no hydrogen 2.947 N/A THR 189.A OG1 LEU 149.A O no hydrogen 2.674 N/A THR 189.A OG1 SER 152.A O no hydrogen 3.165 N/A GLN 191.A N GLU 188.A O no hydrogen 3.041 N/A LEU 192.A N THR 189.A O no hydrogen 3.091 N/A SER 196.A N.A ILE 193.A O no hydrogen 3.050 N/A ILE 197.A N ILE 193.A O no hydrogen 3.036 N/A HIS 198.A N GLU 194.A O no hydrogen 2.919 N/A HIS 198.A ND1 GLU 142.A OE1 no hydrogen 2.824 N/A HIS 198.A ND1 GLU 142.A OE2 no hydrogen 3.223 N/A LEU 199.A N SER 195.A O no hydrogen 3.064 N/A LEU 200.A N SER 196.A O.A no hydrogen 2.863 N/A LEU 200.A N SER 196.A O.B no hydrogen 2.841 N/A HIS 201.A N ILE 197.A O no hydrogen 2.897 N/A HIS 201.A ND1 ASP 202.A OD1 no hydrogen 3.160 N/A HIS 201.A NE2 PHE 140.A O no hydrogen 2.801 N/A ASP 202.A N HIS 198.A O no hydrogen 3.130 N/A SER 203.A N LEU 199.A O no hydrogen 2.901 N/A SER 203.A OG LEU 199.A O no hydrogen 2.635 N/A ILE 204.A N LEU 200.A O no hydrogen 2.848 N/A ILE 205.A N HIS 201.A O no hydrogen 3.345 N/A GLU 206.A N ASP 202.A O no hydrogen 2.862 N/A ILE 207.A N SER 203.A O no hydrogen 2.895 N/A LEU 208.A N ILE 204.A O no hydrogen 3.200 N/A GLN 209.A N ILE 205.A O no hydrogen 2.917 N/A LYS 210.A N GLU 206.A O no hydrogen 2.839 N/A LYS 210.A NZ GLU 230.A OE2 no hydrogen 2.941 N/A ALA 211.A N ILE 207.A O no hydrogen 2.854 N/A ILE 212.A N LEU 208.A O no hydrogen 2.958 N/A LYS 213.A N GLN 209.A O no hydrogen 3.153 N/A LEU 214.A N LYS 210.A O no hydrogen 3.054 N/A GLY 215.A N ILE 212.A O no hydrogen 2.980 N/A GLY 216.A N ALA 211.A O no hydrogen 2.773 N/A SER 217.A N GLU 5.A OE1 no hydrogen 2.821 N/A SER 217.A OG TYR 173.A OH no hydrogen 2.814 N/A SER 218.A N GLN 228.A OE1 no hydrogen 2.810 N/A SER 218.A OG GLY 222.A O no hydrogen 2.963 N/A LEU 221.A N TYR 79.A O no hydrogen 2.826 N/A GLY 222.A N GLU 12.A OE2 no hydrogen 3.201 N/A SER 223.A N ALA 220.A O no hydrogen 3.501 N/A SER 223.A OG ALA 220.A O no hydrogen 2.443 N/A GLY 225.A N SER 218.A OG no hydrogen 2.855 N/A GLY 225.A N GLY 222.A O no hydrogen 3.414 N/A LYS 226.A N LEU 214.A O no hydrogen 2.731 N/A LYS 226.A NZ THR 224.A O no hydrogen 2.816 N/A MET 227.A N GLY 216.A O no hydrogen 3.094 N/A GLN 228.A NE2 GLY 225.A O no hydrogen 2.942 N/A ASN 229.A N LYS 226.A O no hydrogen 3.251 N/A GLU 230.A N MET 227.A O no hydrogen 2.796 N/A GLN 232.A N GLU 176.A OE1 no hydrogen 2.677 N/A GLN 232.A NE2 GLU 230.A O no hydrogen 3.100 N/A VAL 233.A N GLU 176.A OE2 no hydrogen 2.855 N/A TYR 234.A N GLU 176.A OE2 no hydrogen 2.900 N/A LYS 236.A N VAL 233.A O no hydrogen 2.919 N/A GLY 238.A N ILE 248.A O no hydrogen 2.917 N/A GLU 239.A N LYS 236.A O no hydrogen 2.900 N/A LYS 240.A NZ GLU 247.A OE1 no hydrogen 3.405 N/A CYS 241.A N ALA 246.A O no hydrogen 2.644 N/A SER 242.A OG GLN 232.A OE1 no hydrogen 2.595 N/A ARG 243.A NH1 TRP 179.A O no hydrogen 3.133 N/A ARG 243.A NH1 LEU 180.A O no hydrogen 3.545 N/A ARG 243.A NH2 TRP 179.A O no hydrogen 2.643 N/A GLY 245.A N CYS 241.A O no hydrogen 3.048 N/A ILE 248.A N GLU 239.A O no hydrogen 2.751 N/A GLN 249.A N PHE 260.A O no hydrogen 2.878 N/A GLN 249.A NE2 GLU 247.A O no hydrogen 3.602 N/A ILE 251.A N THR 258.A O no hydrogen 2.854 N/A VAL 253.A N ARG 256.A O no hydrogen 2.999 N/A ARG 256.A N VAL 253.A O no hydrogen 2.931 N/A THR 258.A N ILE 251.A O no hydrogen 2.770 N/A THR 258.A OG1 ARG 256.A O no hydrogen 2.991 N/A HIS 259.A N ASP 175.A OD2 no hydrogen 2.840 N/A HIS 259.A ND1 ASP 175.A OD2 no hydrogen 2.891 N/A PHE 260.A N GLN 249.A O no hydrogen 3.018 N/A CYS 261.A N GLN 265.A OE1 no hydrogen 2.969 N/A GLN 265.A N CYS 261.A O no hydrogen 2.924 N/A GLN 265.A NE2 ILE 183.A O no hydrogen 2.764 N/A GLN 266.A NE2 VAL 263.A O no hydrogen 2.715 N/A