Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4lja_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N GLU 3.A OE1 no hydrogen 3.135 N/A GLU 3.A N GLU 3.A OE1 no hydrogen 2.592 N/A THR 5.A N ASP 8.A OD2 no hydrogen 2.910 N/A THR 5.A OG1 GLU 7.A OE1 no hydrogen 3.478 N/A ASP 8.A N THR 5.A OG1 no hydrogen 3.040 N/A ILE 9.A N THR 5.A O no hydrogen 3.320 N/A ALA 10.A N GLU 6.A O no hydrogen 2.982 N/A GLU 11.A N GLU 7.A O no hydrogen 2.845 N/A ILE 12.A N ASP 8.A O no hydrogen 3.238 N/A VAL 13.A N ILE 9.A O no hydrogen 3.094 N/A SER 14.A N ALA 10.A O no hydrogen 2.682 N/A SER 14.A OG ILE 19.A O no hydrogen 2.865 N/A ARG 15.A N GLU 11.A O no hydrogen 3.001 N/A ARG 15.A NE GLU 11.A OE2 no hydrogen 3.272 N/A TRP 16.A N ILE 12.A O no hydrogen 2.967 N/A THR 17.A N VAL 13.A O no hydrogen 2.912 N/A THR 17.A OG1 VAL 13.A O no hydrogen 2.651 N/A GLY 18.A N SER 14.A O no hydrogen 2.752 N/A ILE 19.A N THR 17.A OG1 no hydrogen 3.141 N/A VAL 21.A N ASP 93.A OD1 no hydrogen 2.979 N/A SER 22.A N ASP 93.A OD2 no hydrogen 2.791 N/A SER 22.A OG ASP 93.A OD2 no hydrogen 2.969 N/A LYS 23.A NZ GLU 26.A OE1 no hydrogen 3.365 N/A LEU 24.A N PRO 20.A O no hydrogen 3.041 N/A LEU 25.A N VAL 21.A O no hydrogen 2.773 N/A GLU 26.A N LYS 23.A O no hydrogen 3.472 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.849 N/A GLU 34.A N ARG 30.A O no hydrogen 3.257 N/A LEU 35.A N LEU 31.A O no hydrogen 2.913 N/A HIS 36.A N GLU 32.A O no hydrogen 2.911 N/A HIS 36.A ND1 VAL 39.A O no hydrogen 2.895 N/A LYS 37.A N GLU 33.A O no hydrogen 3.250 N/A LYS 37.A N GLU 34.A O no hydrogen 3.209 N/A ARG 38.A N LEU 35.A O no hydrogen 3.166 N/A ARG 38.A NE GLU 82.A OE2 no hydrogen 3.282 N/A ARG 38.A NH1 GLU 95.A OE2 no hydrogen 2.700 N/A ARG 38.A NH2 GLU 82.A OE2 no hydrogen 2.964 N/A ARG 38.A NH2 GLU 95.A OE2 no hydrogen 2.729 N/A VAL 39.A N LEU 35.A O no hydrogen 2.921 N/A GLN 42.A NE2 VAL 78.A O no hydrogen 2.930 N/A GLN 42.A NE2 ARG 227.A O no hydrogen 2.836 N/A ILE 46.A N GLN 42.A O no hydrogen 3.022 N/A ARG 47.A N ASP 43.A O no hydrogen 2.953 N/A ALA 48.A N GLU 44.A O no hydrogen 2.925 N/A VAL 49.A N ALA 45.A O no hydrogen 3.086 N/A ALA 50.A N ILE 46.A O no hydrogen 3.041 N/A ASP 51.A N ARG 47.A O no hydrogen 2.857 N/A ALA 52.A N ALA 48.A O no hydrogen 3.192 N/A ILE 53.A N VAL 49.A O no hydrogen 3.018 N/A ARG 54.A N ALA 50.A O no hydrogen 2.860 N/A ARG 54.A NH1 GLU 32.A OE1 no hydrogen 3.179 N/A ARG 54.A NH2 GLU 32.A OE2 no hydrogen 2.421 N/A ARG 54.A NH2 ASP 51.A OD1 no hydrogen 3.064 N/A ARG 55.A N ASP 51.A O no hydrogen 2.972 N/A ARG 55.A NH2 ASP 221.A OD2 no hydrogen 3.307 N/A ALA 56.A N ALA 52.A O no hydrogen 3.041 N/A ARG 57.A N ILE 53.A O no hydrogen 2.984 N/A ALA 58.A N ARG 54.A O no hydrogen 2.970 N/A GLY 59.A N ALA 56.A O no hydrogen 3.036 N/A LEU 60.A N ARG 55.A O no hydrogen 3.046 N/A LYS 61.A NZ ASP 221.A OD2 no hydrogen 2.907 N/A ASN 64.A N ASP 62.A OD1 no hydrogen 2.793 N/A ARG 65.A NH1 ARG 219.A O no hydrogen 3.047 N/A ARG 65.A NH2 ARG 219.A O no hydrogen 3.070 N/A ILE 67.A N THR 174.A O no hydrogen 2.937 N/A SER 69.A N ASP 221.A OD1 no hydrogen 2.797 N/A SER 69.A OG ASP 221.A OD1 no hydrogen 3.473 N/A PHE 70.A N ILE 176.A O no hydrogen 2.871 N/A LEU 71.A N GLU 222.A O no hydrogen 3.135 N/A PHE 72.A N LEU 178.A O no hydrogen 2.777 N/A LEU 73.A N VAL 224.A O no hydrogen 2.710 N/A LYS 80.A NZ PHE 72.A O no hydrogen 2.887 N/A LYS 80.A NZ GLY 74.A O no hydrogen 2.727 N/A LEU 83.A N GLY 79.A O no hydrogen 2.856 N/A ALA 84.A N LYS 80.A O no hydrogen 3.138 N/A LYS 85.A N THR 81.A O no hydrogen 2.848 N/A THR 86.A N GLU 82.A O no hydrogen 3.027 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.631 N/A LEU 87.A N LEU 83.A O no hydrogen 2.861 N/A ALA 88.A N ALA 84.A O no hydrogen 3.014 N/A ALA 89.A N LYS 85.A O no hydrogen 2.930 N/A THR 90.A N THR 86.A O no hydrogen 2.905 N/A THR 90.A OG1 THR 86.A O no hydrogen 2.855 N/A LEU 91.A N LEU 87.A O no hydrogen 2.889 N/A PHE 92.A N ALA 88.A O no hydrogen 2.893 N/A GLU 96.A N THR 94.A OG1 no hydrogen 3.104 N/A ALA 97.A N THR 94.A O no hydrogen 3.127 N/A MET 98.A N GLU 95.A O no hydrogen 2.989 N/A ILE 99.A N VAL 135.A O no hydrogen 2.849 N/A ILE 101.A N LEU 137.A O no hydrogen 2.793 N/A MET 103.A N ASP 139.A O no hydrogen 2.988 N/A THR 104.A N ASP 102.A OD1 no hydrogen 3.036 N/A THR 104.A OG1 ASP 102.A OD1 no hydrogen 2.663 N/A GLU 105.A N ASP 102.A O no hydrogen 2.891 N/A TYR 106.A N MET 103.A O no hydrogen 2.835 N/A LYS 109.A NZ ASP 147.A OD2 no hydrogen 2.775 N/A ALA 111.A N GLU 108.A O no hydrogen 3.192 N/A SER 113.A OG HIS 110.A O no hydrogen 2.796 N/A ARG 114.A N ALA 111.A O no hydrogen 2.895 N/A ARG 114.A NH1 GLU 105.A OE1 no hydrogen 3.136 N/A LEU 115.A N ALA 111.A O no hydrogen 3.307 N/A LEU 115.A N VAL 112.A O no hydrogen 2.921 N/A ILE 116.A N VAL 112.A O no hydrogen 2.993 N/A GLY 117.A N SER 113.A O no hydrogen 2.880 N/A GLY 122.A N THR 125.A OG1 no hydrogen 3.005 N/A GLN 123.A N ARG 114.A O no hydrogen 2.908 N/A THR 125.A N LEU 115.A O no hydrogen 3.439 N/A THR 125.A OG1 ILE 116.A O no hydrogen 3.549 N/A THR 125.A OG1 GLY 122.A O no hydrogen 3.443 N/A GLU 126.A N GLY 122.A O no hydrogen 3.058 N/A ALA 127.A N GLN 123.A O no hydrogen 3.030 N/A VAL 128.A N LEU 124.A O no hydrogen 2.876 N/A ARG 129.A N THR 125.A O no hydrogen 2.839 N/A ARG 129.A NH2 ASP 163.A OD2 no hydrogen 2.984 N/A ARG 130.A N GLU 126.A O no hydrogen 3.193 N/A ARG 131.A N ALA 127.A O no hydrogen 3.070 N/A SER 134.A OG ARG 131.A O no hydrogen 2.619 N/A VAL 135.A N ALA 97.A O no hydrogen 2.912 N/A ILE 136.A N VAL 175.A O no hydrogen 2.799 N/A LEU 137.A N ILE 99.A O no hydrogen 2.772 N/A PHE 138.A N ILE 177.A O no hydrogen 2.859 N/A ASP 139.A N ILE 101.A O no hydrogen 2.891 N/A GLU 140.A N THR 179.A OG1 no hydrogen 3.312 N/A ILE 141.A N THR 179.A O no hydrogen 3.035 N/A GLU 142.A N GLU 142.A OE1 no hydrogen 2.790 N/A LYS 143.A N GLU 140.A O no hydrogen 2.970 N/A LYS 143.A NZ GLU 140.A OE1 no hydrogen 2.737 N/A ALA 144.A N ILE 141.A O no hydrogen 3.190 N/A HIS 145.A N TYR 106.A O no hydrogen 2.955 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.185 N/A PHE 149.A N HIS 145.A O no hydrogen 2.881 N/A ASN 150.A N PRO 146.A O no hydrogen 2.927 N/A ILE 151.A N VAL 148.A O no hydrogen 3.121 N/A LEU 153.A N PHE 149.A O no hydrogen 3.301 N/A GLN 154.A N ASN 150.A O no hydrogen 3.203 N/A ILE 155.A N ILE 151.A O no hydrogen 3.308 N/A LEU 156.A N LEU 152.A O no hydrogen 3.069 N/A ASP 157.A N LEU 153.A O no hydrogen 2.835 N/A ASP 158.A N GLN 154.A O no hydrogen 2.808 N/A GLY 159.A N ILE 155.A O no hydrogen 2.903 N/A LEU 161.A N VAL 169.A O no hydrogen 2.904 N/A ASP 163.A N ARG 167.A O no hydrogen 2.984 N/A SER 164.A N ILE 116.A O no hydrogen 3.318 N/A SER 164.A OG GLY 117.A O no hydrogen 2.644 N/A HIS 165.A N ASP 163.A OD1 no hydrogen 3.135 N/A GLY 166.A N ASP 163.A O no hydrogen 3.209 N/A GLY 166.A N ASP 163.A OD1 no hydrogen 3.255 N/A ARG 167.A N ASP 163.A OD1 no hydrogen 3.110 N/A VAL 169.A N LEU 161.A O no hydrogen 2.544 N/A PHE 171.A N GLY 159.A O no hydrogen 2.957 N/A ARG 172.A N ASP 170.A OD1 no hydrogen 2.981 N/A ARG 172.A NE ASP 170.A OD1 no hydrogen 2.937 N/A ARG 172.A NE ASP 170.A OD2 no hydrogen 3.132 N/A ARG 172.A NH2 ASP 170.A OD2 no hydrogen 2.659 N/A THR 174.A N PHE 171.A O no hydrogen 3.067 N/A THR 174.A OG1 PHE 171.A O no hydrogen 2.821 N/A VAL 175.A N SER 134.A O no hydrogen 3.031 N/A ILE 176.A N GLY 68.A O no hydrogen 2.795 N/A ILE 177.A N ILE 136.A O no hydrogen 2.866 N/A LEU 178.A N PHE 70.A O no hydrogen 2.905 N/A THR 179.A N PHE 138.A O no hydrogen 2.911 N/A THR 179.A OG1 ASP 139.A OD1 no hydrogen 2.700 N/A SER 180.A N PHE 72.A O no hydrogen 3.250 N/A SER 180.A OG GLU 142.A OE1 no hydrogen 2.744 N/A LEU 182.A N SER 180.A OG no hydrogen 3.184 N/A SER 184.A N ASN 181.A O no hydrogen 2.956 N/A ILE 187.A N GLY 183.A O no hydrogen 2.982 N/A LEU 188.A N SER 184.A O no hydrogen 3.201 N/A GLU 189.A N PRO 185.A O no hydrogen 2.797 N/A GLY 190.A N LEU 186.A O no hydrogen 2.935 N/A LEU 191.A N ILE 187.A O no hydrogen 2.909 N/A GLN 192.A N LEU 188.A O no hydrogen 3.075 N/A GLN 192.A NE2 LEU 188.A O no hydrogen 3.568 N/A LYS 193.A N GLU 189.A O no hydrogen 2.910 N/A LYS 193.A NZ GLU 189.A OE2 no hydrogen 3.216 N/A TRP 195.A N GLY 190.A O no hydrogen 2.788 N/A ARG 199.A N PRO 196.A O no hydrogen 2.915 N/A ARG 199.A NE GLU 203.A OE2 no hydrogen 3.358 N/A ILE 200.A N PRO 196.A O no hydrogen 3.347 N/A ARG 201.A N TYR 197.A O no hydrogen 2.915 N/A ASP 202.A N GLU 198.A O no hydrogen 3.102 N/A GLU 203.A N ARG 199.A O no hydrogen 2.997 N/A VAL 204.A N ILE 200.A O no hydrogen 3.097 N/A PHE 205.A N ARG 201.A O no hydrogen 3.071 N/A LYS 206.A N ASP 202.A O no hydrogen 3.008 N/A VAL 207.A N GLU 203.A O no hydrogen 3.084 N/A LEU 208.A N VAL 204.A O no hydrogen 3.081 N/A GLN 209.A N PHE 205.A O no hydrogen 2.995 N/A GLN 210.A N LYS 206.A O no hydrogen 2.989 N/A HIS 211.A N VAL 207.A O no hydrogen 3.158 N/A HIS 211.A ND1 VAL 207.A O no hydrogen 3.080 N/A PHE 212.A N LEU 208.A O no hydrogen 2.892 N/A ARG 213.A NH2 GLN 209.A OE1 no hydrogen 3.565 N/A ARG 213.A NH2 PHE 212.A O no hydrogen 3.461 N/A GLU 215.A N GLU 215.A OE2 no hydrogen 2.810 N/A PHE 216.A N ARG 213.A O no hydrogen 3.056 N/A LEU 217.A N ARG 213.A O no hydrogen 3.086 N/A ASN 218.A N PRO 214.A O no hydrogen 2.776 N/A ARG 219.A N PHE 216.A O no hydrogen 2.984 N/A ARG 219.A NE ASP 157.A OD1 no hydrogen 2.741 N/A ARG 219.A NE ASP 157.A OD2 no hydrogen 3.347 N/A ARG 219.A NH1 GLU 215.A O no hydrogen 2.982 N/A ARG 219.A NH2 ASP 157.A OD2 no hydrogen 2.993 N/A LEU 220.A N LEU 217.A O no hydrogen 3.030 N/A GLU 222.A N SER 69.A O no hydrogen 3.473 N/A VAL 224.A N LEU 71.A O no hydrogen 2.832 N/A PHE 226.A N LEU 73.A O no hydrogen 2.819 N/A ARG 227.A N GLN 42.A OE1 no hydrogen 3.057 N/A LEU 229.A N TYR 271.A OH no hydrogen 3.138 N/A THR 230.A N GLN 233.A OE1 no hydrogen 3.012 N/A GLN 233.A N THR 230.A OG1 no hydrogen 3.295 N/A ILE 234.A N THR 230.A O no hydrogen 3.083 N/A ARG 235.A N LYS 231.A O no hydrogen 3.091 N/A ARG 235.A NE GLU 232.A OE1 no hydrogen 3.161 N/A ARG 235.A NH1 ASP 264.A OD1 no hydrogen 3.461 N/A GLN 236.A N GLU 232.A O no hydrogen 3.044 N/A GLN 236.A NE2 GLU 232.A OE2 no hydrogen 3.159 N/A ILE 237.A N GLN 233.A O no hydrogen 3.115 N/A VAL 238.A N ILE 234.A O no hydrogen 2.894 N/A GLU 239.A N ARG 235.A O no hydrogen 3.192 N/A ILE 240.A N GLN 236.A O no hydrogen 3.159 N/A GLN 241.A N ILE 237.A O no hydrogen 2.826 N/A LEU 242.A N GLU 239.A O no hydrogen 3.133 N/A SER 243.A N ILE 240.A O no hydrogen 3.070 N/A SER 243.A OG GLU 239.A O no hydrogen 3.499 N/A SER 243.A OG ILE 240.A O no hydrogen 2.972 N/A ARG 246.A N LEU 242.A O no hydrogen 2.855 N/A ARG 246.A NH1 LEU 256.A O no hydrogen 2.650 N/A ARG 246.A NH2 GLU 239.A OE1 no hydrogen 3.098 N/A ALA 247.A N SER 243.A O no hydrogen 2.890 N/A ARG 248.A N TYR 244.A O no hydrogen 2.990 N/A LEU 249.A N LEU 245.A O no hydrogen 2.940 N/A ALA 250.A N ARG 246.A O no hydrogen 2.872 N/A LYS 252.A N LEU 249.A O no hydrogen 3.000 N/A ARG 253.A N ALA 250.A O no hydrogen 2.888 N/A ARG 253.A NH1 GLU 303.A OE1 no hydrogen 2.599 N/A ILE 254.A N LEU 249.A O no hydrogen 2.938 N/A SER 255.A N ASP 305.A O no hydrogen 2.984 N/A GLU 257.A N VAL 307.A O no hydrogen 2.678 N/A THR 259.A N VAL 309.A O no hydrogen 2.919 N/A THR 259.A OG1 VAL 309.A O no hydrogen 3.497 N/A THR 259.A OG1 ASP 310.A OD1 no hydrogen 2.834 N/A ALA 262.A N THR 259.A O no hydrogen 3.205 N/A LYS 263.A N THR 259.A O no hydrogen 3.179 N/A LYS 263.A NZ GLU 239.A OE2 no hydrogen 2.830 N/A ASP 264.A N GLU 260.A O no hydrogen 3.055 N/A PHE 265.A N ALA 261.A O no hydrogen 2.998 N/A LEU 266.A N ALA 262.A O no hydrogen 3.273 N/A ALA 267.A N LYS 263.A O no hydrogen 2.999 N/A GLU 268.A N ASP 264.A O no hydrogen 2.777 N/A ARG 269.A N PHE 265.A O no hydrogen 3.254 N/A ARG 269.A NH1 PHE 265.A O no hydrogen 3.174 N/A GLY 270.A N LEU 266.A O no hydrogen 2.855 N/A ASP 272.A N GLY 276.A O no hydrogen 3.151 N/A VAL 274.A N ASP 272.A OD2 no hydrogen 2.888 N/A PHE 275.A N ASP 272.A OD2 no hydrogen 2.959 N/A ALA 277.A N GLY 77.A O no hydrogen 2.830 N/A ARG 278.A N PHE 275.A O no hydrogen 3.179 N/A ARG 278.A NH1 THR 76.A OG1 no hydrogen 3.407 N/A LEU 280.A N ALA 277.A O no hydrogen 3.018 N/A ARG 281.A NH2 GLN 241.A O no hydrogen 3.509 N/A ARG 281.A NH2 GLN 241.A OE1 no hydrogen 3.567 N/A VAL 283.A N PRO 279.A O no hydrogen 3.166 N/A ILE 284.A N LEU 280.A O no hydrogen 2.913 N/A GLN 285.A N ARG 281.A O no hydrogen 2.987 N/A ARG 286.A N ARG 282.A O no hydrogen 2.981 N/A ARG 286.A NE GLU 287.A OE2 no hydrogen 3.094 N/A ARG 286.A NH2 GLU 287.A OE2 no hydrogen 3.109 N/A GLU 287.A N VAL 283.A O no hydrogen 2.763 N/A LEU 288.A N ILE 284.A O no hydrogen 2.981 N/A GLU 289.A N ILE 284.A O no hydrogen 3.001 N/A THR 290.A N GLN 285.A O no hydrogen 3.027 N/A THR 290.A OG1 GLN 285.A O no hydrogen 3.158 N/A LEU 292.A N LEU 288.A O no hydrogen 3.045 N/A ALA 293.A N GLU 289.A O no hydrogen 2.860 N/A GLN 294.A N THR 290.A O no hydrogen 3.147 N/A LYS 295.A N PRO 291.A O no hydrogen 3.218 N/A LYS 295.A NZ GLU 300.A OE1 no hydrogen 3.314 N/A ILE 296.A N LEU 292.A O no hydrogen 3.045 N/A LEU 297.A N ALA 293.A O no hydrogen 2.966 N/A ALA 298.A N GLN 294.A O no hydrogen 2.876 N/A GLY 299.A N ILE 296.A O no hydrogen 3.132 N/A GLU 300.A N LYS 295.A O no hydrogen 2.936 N/A VAL 301.A N LYS 295.A O no hydrogen 3.123 N/A LYS 302.A N ASP 305.A OD2 no hydrogen 2.795 N/A LYS 302.A NZ GLY 299.A O no hydrogen 2.796 N/A GLY 304.A N LYS 252.A O no hydrogen 3.075 N/A ASP 305.A N LYS 302.A O no hydrogen 3.145 N/A ARG 306.A NE GLU 257.A OE2 no hydrogen 3.518 N/A VAL 307.A N SER 255.A O no hydrogen 2.777 N/A GLN 308.A N ALA 319.A O no hydrogen 2.877 N/A VAL 309.A N GLU 257.A O no hydrogen 2.916 N/A ASP 310.A N VAL 317.A O no hydrogen 2.903 N/A VAL 311.A N ASP 310.A OD1 no hydrogen 2.736 N/A GLY 312.A N GLY 315.A O no hydrogen 2.627 N/A VAL 317.A N ASP 310.A O no hydrogen 2.793 N/A ALA 319.A N GLN 308.A O no hydrogen 2.947 N/A