Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1puj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N HIS 1.A O no hydrogen 3.214 N/A ARG 7.A N ALA 3.A O no hydrogen 2.904 N/A GLU 8.A N LYS 4.A O no hydrogen 3.235 N/A VAL 9.A N ALA 5.A O no hydrogen 3.285 N/A THR 10.A N ARG 6.A O no hydrogen 3.110 N/A THR 10.A OG1 ARG 6.A O no hydrogen 2.802 N/A GLU 11.A N ARG 7.A O no hydrogen 2.919 N/A LYS 12.A N GLU 8.A O no hydrogen 3.214 N/A LYS 12.A NZ ASP 151.A O no hydrogen 3.351 N/A LEU 13.A N VAL 9.A O no hydrogen 2.891 N/A LYS 14.A N GLU 11.A O no hydrogen 3.173 N/A LYS 14.A NZ THR 10.A O no hydrogen 2.772 N/A LYS 14.A NZ GLU 11.A OE1 no hydrogen 2.906 N/A LEU 15.A N LYS 12.A O no hydrogen 3.092 N/A ILE 16.A N LEU 13.A O no hydrogen 3.404 N/A ASP 17.A N ARG 114.A O no hydrogen 2.636 N/A ILE 18.A N ARG 114.A O no hydrogen 3.197 N/A VAL 19.A N PRO 44.A O no hydrogen 2.830 N/A TYR 20.A N LEU 116.A O no hydrogen 2.669 N/A TYR 20.A OH SER 92.A OG no hydrogen 2.700 N/A GLU 21.A N ILE 46.A O no hydrogen 3.014 N/A LEU 22.A N ILE 118.A O no hydrogen 2.928 N/A VAL 23.A N LEU 48.A O no hydrogen 2.898 N/A ASP 24.A N SER 31.A OG no hydrogen 2.920 N/A ALA 25.A N ASN 50.A O no hydrogen 2.888 N/A ARG 26.A N ASP 24.A OD1 no hydrogen 2.943 N/A ARG 26.A NE ASP 24.A OD1 no hydrogen 3.032 N/A ARG 26.A NE ASP 24.A OD2 no hydrogen 3.377 N/A ARG 26.A NH2 ASP 24.A OD2 no hydrogen 2.711 N/A ARG 26.A NH2 THR 172.A O no hydrogen 3.293 N/A ILE 27.A N ASP 24.A O no hydrogen 2.796 N/A MET 29.A N GLU 258.A OE1 no hydrogen 2.709 N/A SER 30.A N GLU 258.A OE1 no hydrogen 2.819 N/A SER 30.A OG GLU 258.A OE1 no hydrogen 3.560 N/A SER 30.A OG GLU 258.A OE2 no hydrogen 2.507 N/A SER 31.A N ILE 27.A O no hydrogen 2.961 N/A SER 31.A OG ILE 27.A O no hydrogen 2.673 N/A ARG 32.A N MET 29.A O no hydrogen 3.043 N/A ARG 32.A NE GLU 37.A OE2 no hydrogen 2.920 N/A ARG 32.A NH2 GLU 37.A OE1 no hydrogen 3.167 N/A ARG 32.A NH2 GLU 37.A OE2 no hydrogen 3.126 N/A ASN 33.A ND2 ILE 155.A O no hydrogen 2.779 N/A ASN 33.A ND2 LEU 156.A O no hydrogen 2.687 N/A ILE 36.A N ASN 33.A OD1 no hydrogen 3.172 N/A GLU 37.A N ASN 33.A O no hydrogen 2.997 N/A ASP 38.A N PRO 34.A O no hydrogen 3.144 N/A ILE 39.A N ILE 36.A O no hydrogen 2.948 N/A LEU 40.A N ILE 36.A O no hydrogen 3.303 N/A LEU 40.A N GLU 37.A O no hydrogen 2.942 N/A LYS 43.A NZ LEU 13.A O no hydrogen 2.876 N/A LYS 43.A NZ ILE 16.A O no hydrogen 2.994 N/A ARG 45.A NH1 GLU 37.A OE2 no hydrogen 3.247 N/A ILE 46.A N VAL 19.A O no hydrogen 2.898 N/A MET 47.A N ARG 73.A O no hydrogen 2.854 N/A LEU 48.A N GLU 21.A O no hydrogen 2.820 N/A LEU 49.A N LEU 75.A O no hydrogen 2.778 N/A ASN 50.A N VAL 23.A O no hydrogen 2.864 N/A ASN 50.A ND2 SER 79.A OG no hydrogen 2.647 N/A LYS 51.A NZ ASN 122.A O no hydrogen 2.844 N/A LYS 51.A NZ ASN 122.A OD1 no hydrogen 3.494 N/A ALA 52.A N ILE 77.A O no hydrogen 3.079 N/A LYS 54.A N LYS 51.A O no hydrogen 2.913 N/A LYS 54.A NZ ARG 248.A O no hydrogen 2.874 N/A LYS 54.A NZ GLU 250.A OE2 no hydrogen 2.712 N/A ALA 55.A N ALA 52.A O no hydrogen 3.322 N/A ASP 56.A N SER 256.A OG no hydrogen 2.916 N/A VAL 59.A N ASP 56.A OD1 no hydrogen 3.049 N/A THR 60.A N ASP 56.A O no hydrogen 2.888 N/A THR 60.A OG1 ASP 56.A O no hydrogen 3.120 N/A GLN 61.A N ALA 57.A O no hydrogen 3.066 N/A GLN 61.A NE2 GLU 65.A OE2 no hydrogen 2.828 N/A GLN 62.A N ALA 58.A O no hydrogen 3.156 N/A TRP 63.A N VAL 59.A O no hydrogen 2.942 N/A TRP 63.A NE1 GLU 258.A O no hydrogen 2.845 N/A LYS 64.A N THR 60.A O no hydrogen 2.940 N/A LYS 64.A NZ SER 76.A OG no hydrogen 2.978 N/A GLU 65.A N GLN 61.A O no hydrogen 3.093 N/A HIS 66.A N GLN 62.A O no hydrogen 2.970 N/A PHE 67.A N TRP 63.A O no hydrogen 2.967 N/A GLU 68.A N LYS 64.A O no hydrogen 2.930 N/A ASN 69.A N GLU 65.A O no hydrogen 2.882 N/A GLN 70.A N PHE 67.A O no hydrogen 2.907 N/A GLN 70.A NE2 HIS 66.A NE2 no hydrogen 2.790 N/A GLY 71.A N GLU 68.A O no hydrogen 2.892 N/A ILE 72.A N PHE 67.A O no hydrogen 2.929 N/A SER 74.A N GLU 68.A OE2 no hydrogen 2.873 N/A SER 74.A OG ILE 72.A O no hydrogen 3.025 N/A LEU 75.A N MET 47.A O no hydrogen 2.876 N/A ILE 77.A N LEU 49.A O no hydrogen 2.878 N/A ASN 78.A N GLN 83.A O no hydrogen 2.926 N/A VAL 80.A N ASN 78.A OD1 no hydrogen 2.938 N/A ASN 81.A N ASN 78.A OD1 no hydrogen 3.268 N/A GLY 82.A N ASN 78.A O no hydrogen 2.869 N/A GLN 83.A NE2 SER 76.A O no hydrogen 3.239 N/A LEU 85.A N GLY 82.A O no hydrogen 2.995 N/A GLN 87.A N GLY 84.A O no hydrogen 3.177 N/A ILE 88.A N LEU 85.A O no hydrogen 3.311 N/A ALA 91.A N GLN 87.A O no hydrogen 3.039 N/A SER 92.A N ILE 88.A O no hydrogen 2.916 N/A SER 92.A OG TYR 20.A OH no hydrogen 2.700 N/A SER 92.A OG ILE 88.A O no hydrogen 2.702 N/A LYS 93.A N VAL 89.A O no hydrogen 2.986 N/A LYS 93.A NZ GLU 146.A OE1 no hydrogen 3.545 N/A GLU 94.A N PRO 90.A O no hydrogen 3.185 N/A ILE 95.A N ALA 91.A O no hydrogen 3.028 N/A LEU 96.A N SER 92.A O no hydrogen 3.055 N/A GLN 97.A N GLU 94.A O no hydrogen 3.314 N/A LYS 99.A NZ ASP 17.A OD1 no hydrogen 2.742 N/A PHE 100.A N LEU 96.A O no hydrogen 2.902 N/A ASP 101.A N GLN 97.A O no hydrogen 2.814 N/A ARG 102.A N GLU 98.A O no hydrogen 3.010 N/A MET 103.A N LYS 99.A O no hydrogen 3.006 N/A ARG 104.A N PHE 100.A O no hydrogen 2.871 N/A ALA 105.A N ASP 101.A O no hydrogen 3.056 N/A LYS 106.A N ARG 102.A O no hydrogen 3.256 N/A LYS 106.A N MET 103.A O no hydrogen 3.022 N/A GLY 107.A N ARG 104.A O no hydrogen 3.008 N/A VAL 108.A N MET 103.A O no hydrogen 3.053 N/A ILE 113.A N GLU 146.A O no hydrogen 2.983 N/A ARG 114.A N ASP 17.A OD2 no hydrogen 2.923 N/A ARG 114.A NE GLU 148.A OE1 no hydrogen 3.290 N/A ARG 114.A NH2 GLU 148.A OE1 no hydrogen 3.543 N/A ALA 115.A N GLU 148.A O no hydrogen 2.951 N/A LEU 116.A N ILE 18.A O no hydrogen 2.949 N/A ILE 117.A N LEU 150.A O no hydrogen 3.005 N/A ILE 118.A N TYR 20.A O no hydrogen 3.105 N/A VAL 123.A N ILE 120.A O no hydrogen 3.333 N/A LYS 125.A NZ GLY 119.A O no hydrogen 3.255 N/A LYS 125.A NZ ILE 120.A O no hydrogen 2.971 N/A LEU 128.A N GLY 124.A O no hydrogen 3.032 N/A ILE 129.A N LYS 125.A O no hydrogen 3.155 N/A ASN 130.A N SER 126.A O no hydrogen 2.886 N/A ASN 130.A ND2 ALA 138.A O no hydrogen 2.884 N/A ARG 131.A N THR 127.A O no hydrogen 2.903 N/A LEU 132.A N LEU 128.A O no hydrogen 2.877 N/A ALA 133.A N ILE 129.A O no hydrogen 2.761 N/A LYS 134.A N ARG 131.A O no hydrogen 3.138 N/A LYS 135.A N ASN 130.A O no hydrogen 3.114 N/A LYS 135.A NZ ALA 133.A O no hydrogen 3.139 N/A ILE 137.A N ASN 130.A OD1 no hydrogen 3.307 N/A ALA 138.A N ASN 130.A OD1 no hydrogen 2.944 N/A VAL 141.A N LEU 149.A O no hydrogen 2.659 N/A VAL 143.A N LEU 147.A O no hydrogen 2.944 N/A LEU 147.A N VAL 143.A O no hydrogen 3.368 N/A GLU 148.A N ILE 113.A O no hydrogen 2.761 N/A LEU 149.A N VAL 141.A O no hydrogen 2.756 N/A LEU 150.A N ALA 115.A O no hydrogen 3.042 N/A THR 152.A OG1 ILE 117.A O no hydrogen 2.618 N/A ILE 155.A N GLY 119.A O no hydrogen 3.317 N/A PHE 160.A N PRO 158.A O no hydrogen 3.064 N/A LEU 164.A N ASP 162.A OD1 no hydrogen 2.810 N/A VAL 165.A N ASP 162.A OD1 no hydrogen 3.264 N/A GLY 166.A N ASP 162.A O no hydrogen 3.099 N/A LEU 167.A N GLU 163.A O no hydrogen 2.913 N/A ARG 168.A N LEU 164.A O no hydrogen 3.047 N/A ARG 168.A NH1 SER 30.A OG no hydrogen 3.167 N/A LEU 169.A N VAL 165.A O no hydrogen 3.048 N/A ALA 170.A N GLY 166.A O no hydrogen 2.890 N/A VAL 171.A N LEU 167.A O no hydrogen 2.934 N/A THR 172.A N ARG 168.A O no hydrogen 3.195 N/A THR 172.A OG1 ARG 168.A O no hydrogen 2.865 N/A THR 172.A OG1 LEU 169.A O no hydrogen 3.029 N/A GLY 173.A N ALA 170.A O no hydrogen 3.211 N/A ALA 174.A N LEU 169.A O no hydrogen 2.951 N/A ILE 179.A N LYS 176.A O no hydrogen 3.387 N/A ASP 184.A N ASN 181.A O no hydrogen 3.120 N/A ASP 184.A N ASN 181.A OD1 no hydrogen 3.366 N/A ALA 186.A N LEU 182.A O no hydrogen 2.929 N/A VAL 187.A N GLN 183.A O no hydrogen 2.799 N/A PHE 188.A N ASP 184.A O no hydrogen 3.006 N/A GLY 189.A N VAL 185.A O no hydrogen 2.811 N/A LEU 190.A N ALA 186.A O no hydrogen 2.889 N/A ARG 191.A N VAL 187.A O no hydrogen 3.026 N/A PHE 192.A N PHE 188.A O no hydrogen 2.949 N/A LEU 193.A N GLY 189.A O no hydrogen 2.918 N/A GLU 194.A N LEU 190.A O no hydrogen 2.828 N/A GLU 195.A N ARG 191.A O no hydrogen 3.030 N/A GLU 195.A N PHE 192.A O no hydrogen 3.161 N/A HIS 196.A N PHE 192.A O no hydrogen 2.859 N/A TYR 197.A N LEU 193.A O no hydrogen 2.690 N/A ARG 200.A NH1 PHE 252.A O no hydrogen 2.964 N/A ARG 200.A NH1 ARG 254.A O no hydrogen 2.705 N/A LEU 201.A N TYR 197.A O no hydrogen 3.292 N/A LYS 202.A N PRO 198.A O no hydrogen 3.001 N/A LYS 202.A NZ GLU 199.A OE2 no hydrogen 2.864 N/A GLU 203.A N GLU 199.A O no hydrogen 3.013 N/A ARG 204.A N ARG 200.A O no hydrogen 2.895 N/A ARG 204.A NH1 ASP 246.A OD2 no hydrogen 2.820 N/A TYR 205.A N LEU 201.A O no hydrogen 3.320 N/A TYR 205.A OH ASP 246.A OD2 no hydrogen 2.670 N/A GLY 206.A N GLU 203.A O no hydrogen 3.220 N/A LEU 207.A N LYS 202.A O no hydrogen 2.665 N/A ALA 215.A N ASP 213.A OD1 no hydrogen 2.731 N/A GLU 216.A N ASP 213.A OD1 no hydrogen 3.318 N/A LEU 217.A N ASP 213.A O no hydrogen 3.034 N/A PHE 218.A N ILE 214.A O no hydrogen 3.074 N/A ASP 219.A N ALA 215.A O no hydrogen 3.117 N/A ALA 220.A N GLU 216.A O no hydrogen 2.990 N/A ILE 221.A N LEU 217.A O no hydrogen 3.060 N/A GLY 222.A N PHE 218.A O no hydrogen 2.901 N/A GLU 223.A N ASP 219.A O no hydrogen 2.986 N/A LYS 224.A N ALA 220.A O no hydrogen 3.003 N/A ARG 225.A N ILE 221.A O no hydrogen 2.972 N/A GLY 226.A N GLU 223.A O no hydrogen 3.299 N/A CYS 227.A N GLY 222.A O no hydrogen 2.712 N/A MET 229.A N LEU 233.A O no hydrogen 2.738 N/A LEU 233.A N SER 230.A O no hydrogen 3.285 N/A ASN 235.A N CYS 227.A O no hydrogen 2.630 N/A TYR 236.A OH ASP 219.A OD1 no hydrogen 2.512 N/A LYS 238.A N ASN 235.A OD1 no hydrogen 2.758 N/A THR 239.A N ASN 235.A O no hydrogen 3.009 N/A THR 239.A OG1 ASN 235.A O no hydrogen 2.819 N/A THR 240.A N TYR 236.A O no hydrogen 2.846 N/A THR 240.A OG1 TYR 236.A O no hydrogen 2.751 N/A GLU 241.A N ASP 237.A O no hydrogen 3.154 N/A VAL 242.A N LYS 238.A O no hydrogen 3.086 N/A ILE 243.A N THR 239.A O no hydrogen 3.082 N/A ILE 244.A N THR 240.A O no hydrogen 2.999 N/A ARG 245.A N GLU 241.A O no hydrogen 2.765 N/A ASP 246.A N VAL 242.A O no hydrogen 2.777 N/A ILE 247.A N ILE 243.A O no hydrogen 3.057 N/A ARG 248.A N ILE 244.A O no hydrogen 3.007 N/A ARG 248.A NE VAL 171.A O no hydrogen 2.943 N/A ARG 248.A NH1 ASP 177.A OD2 no hydrogen 2.734 N/A ARG 248.A NH2 ALA 170.A O no hydrogen 2.819 N/A ARG 248.A NH2 ASP 177.A OD1 no hydrogen 2.949 N/A ARG 248.A NH2 ASP 177.A OD2 no hydrogen 3.403 N/A THR 249.A N ARG 245.A O no hydrogen 2.822 N/A THR 249.A OG1 ARG 245.A O no hydrogen 2.709 N/A GLU 250.A N ILE 247.A O no hydrogen 3.413 N/A LYS 251.A N ASP 246.A O no hydrogen 2.738 N/A GLY 253.A N GLU 250.A O no hydrogen 2.946 N/A ARG 254.A NH1 ALA 55.A O no hydrogen 2.974 N/A LEU 255.A N LYS 54.A O no hydrogen 2.997 N/A SER 256.A N TYR 197.A OH no hydrogen 3.303 N/A PHE 257.A N ARG 26.A O no hydrogen 2.877 N/A