Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bal_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH2 PRO 88.A O no hydrogen 3.330 N/A TYR 5.A N VAL 16.A O no hydrogen 2.990 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.569 N/A GLN 7.A N TRP 14.A O no hydrogen 3.214 N/A LEU 9.A N THR 12.A O no hydrogen 3.026 N/A TRP 14.A N GLN 7.A O no hydrogen 2.999 N/A GLU 15.A N TYR 99.A OH no hydrogen 3.061 N/A VAL 16.A N TYR 5.A O no hydrogen 3.209 N/A GLU 18.A N THR 3.A O no hydrogen 2.786 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.953 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.477 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 3.085 N/A TYR 20.A N PRO 17.A O no hydrogen 3.148 N/A TYR 20.A OH ASP 84.A OD2 no hydrogen 2.809 N/A GLN 21.A N PHE 38.A O no hydrogen 2.874 N/A GLN 21.A NE2 GLU 18.A O no hydrogen 2.630 N/A SER 24.A N ALA 36.A O no hydrogen 2.975 N/A VAL 26.A N VAL 34.A O no hydrogen 3.091 N/A GLY 29.A N GLY 32.A O no hydrogen 3.027 N/A TYR 31.A OH LEU 166.A O no hydrogen 3.326 N/A GLY 32.A N GLY 29.A O no hydrogen 3.421 N/A SER 33.A N LYS 50.A O no hydrogen 3.159 N/A VAL 34.A N GLY 27.A O no hydrogen 3.225 N/A CYS 35.A N VAL 48.A O no hydrogen 2.721 N/A ALA 36.A N SER 24.A O no hydrogen 2.932 N/A ALA 37.A N VAL 46.A O no hydrogen 2.938 N/A PHE 38.A N GLN 21.A O no hydrogen 2.827 N/A ASP 39.A N LEU 44.A O no hydrogen 2.766 N/A THR 40.A N ARG 19.A O no hydrogen 3.024 N/A THR 40.A OG1 ARG 19.A O no hydrogen 2.702 N/A LYS 41.A N ASP 39.A OD1 no hydrogen 3.303 N/A THR 42.A N ASP 39.A O no hydrogen 3.149 N/A THR 42.A OG1 ASP 39.A OD2 no hydrogen 3.037 N/A VAL 46.A N ALA 37.A O no hydrogen 2.846 N/A ALA 47.A N THR 102.A O no hydrogen 2.937 N/A VAL 48.A N CYS 35.A O no hydrogen 2.774 N/A LYS 49.A N LEU 100.A O no hydrogen 2.890 N/A LYS 49.A NZ ALA 30.A O no hydrogen 2.595 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 3.421 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 2.668 N/A LYS 50.A N SER 33.A O no hydrogen 2.853 N/A LYS 50.A NZ ILE 13.A O no hydrogen 2.519 N/A LEU 51.A N VAL 98.A O no hydrogen 3.111 N/A SER 52.A N TYR 31.A O no hydrogen 2.948 N/A GLN 56.A N ARG 53.A O no hydrogen 3.355 N/A HIS 60.A N SER 57.A OG no hydrogen 3.269 N/A HIS 60.A ND1 ARG 53.A O no hydrogen 2.737 N/A ALA 61.A N SER 57.A O no hydrogen 2.956 N/A LYS 62.A N ILE 58.A O no hydrogen 2.897 N/A LYS 62.A NZ GLU 312.A O no hydrogen 2.674 N/A LYS 62.A NZ ARG 314.A O no hydrogen 3.282 N/A ARG 63.A N ILE 59.A O no hydrogen 3.067 N/A THR 64.A N HIS 60.A O no hydrogen 2.908 N/A THR 64.A OG1 PRO 54.A O no hydrogen 3.003 N/A THR 64.A OG1 HIS 60.A O no hydrogen 2.801 N/A TYR 65.A N ALA 61.A O no hydrogen 3.075 N/A ARG 66.A N LYS 62.A O no hydrogen 2.930 N/A ARG 66.A NE GLU 312.A OE1 no hydrogen 3.517 N/A ARG 66.A NE GLU 312.A OE2 no hydrogen 2.849 N/A ARG 66.A NH2 GLU 312.A OE1 no hydrogen 3.040 N/A GLU 67.A N ARG 63.A O no hydrogen 2.928 N/A LEU 68.A N THR 64.A O no hydrogen 3.150 N/A ARG 69.A N TYR 65.A O no hydrogen 2.896 N/A ARG 69.A NH1 TYR 65.A OH no hydrogen 2.982 N/A ARG 69.A NH2 ASP 308.A O no hydrogen 3.155 N/A LEU 70.A N ARG 66.A O no hydrogen 3.028 N/A LEU 71.A N GLU 67.A O no hydrogen 3.062 N/A LYS 72.A N LEU 68.A O no hydrogen 2.981 N/A LYS 72.A NZ GLU 328.A O no hydrogen 2.857 N/A LYS 72.A NZ GLU 328.A OE1 no hydrogen 2.629 N/A HIS 73.A N ARG 69.A O no hydrogen 3.249 N/A HIS 73.A N LEU 70.A O no hydrogen 3.231 N/A MET 74.A N LEU 70.A O no hydrogen 3.197 N/A LYS 75.A N TYR 136.A OH no hydrogen 3.065 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 3.000 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 3.106 N/A ASN 78.A ND2 GLN 129.A OE1 no hydrogen 3.552 N/A ASN 78.A ND2 LEU 159.A O no hydrogen 3.085 N/A VAL 79.A N HIS 76.A O no hydrogen 3.239 N/A ILE 80.A N ILE 161.A O no hydrogen 3.083 N/A LEU 83.A N VAL 101.A O no hydrogen 2.792 N/A ASP 84.A N VAL 101.A O no hydrogen 3.299 N/A PHE 86.A N TYR 99.A O no hydrogen 3.061 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.718 N/A ALA 89.A N THR 87.A OG1 no hydrogen 3.202 N/A ARG 90.A N GLU 94.A OE2 no hydrogen 3.253 N/A PHE 95.A N LEU 92.A O no hydrogen 3.343 N/A TYR 99.A N PHE 86.A O no hydrogen 3.042 N/A LEU 100.A N LYS 49.A O no hydrogen 3.010 N/A VAL 101.A N ASP 84.A O no hydrogen 2.804 N/A THR 102.A N ALA 47.A O no hydrogen 3.065 N/A THR 102.A OG1 HIS 103.A O no hydrogen 3.079 N/A ALA 107.A N VAL 154.A O no hydrogen 3.133 N/A LEU 109.A N PRO 149.A O no hydrogen 3.204 N/A LEU 109.A N LEU 152.A O no hydrogen 2.806 N/A ASN 111.A N ASP 108.A OD1 no hydrogen 3.029 N/A ILE 112.A N ASP 108.A O no hydrogen 3.256 N/A GLN 116.A N ILE 112.A O no hydrogen 3.107 N/A THR 119.A N HIS 122.A ND1 no hydrogen 3.434 N/A THR 119.A OG1 HIS 122.A ND1 no hydrogen 2.997 N/A HIS 122.A N THR 119.A OG1 no hydrogen 3.240 N/A VAL 123.A N THR 119.A O no hydrogen 3.314 N/A GLN 124.A N ASP 120.A O no hydrogen 2.962 N/A GLN 124.A NE2 ASP 120.A OD2 no hydrogen 2.734 N/A PHE 125.A N ASP 121.A O no hydrogen 3.202 N/A LEU 126.A N HIS 122.A O no hydrogen 2.934 N/A ILE 127.A N VAL 123.A O no hydrogen 3.009 N/A TYR 128.A N GLN 124.A O no hydrogen 3.044 N/A TYR 128.A OH GLU 301.A OE2 no hydrogen 2.760 N/A GLN 129.A N PHE 125.A O no hydrogen 3.133 N/A GLN 129.A NE2 PHE 125.A O no hydrogen 3.291 N/A ILE 130.A N LEU 126.A O no hydrogen 3.002 N/A LEU 131.A N ILE 127.A O no hydrogen 2.915 N/A ARG 132.A N TYR 128.A O no hydrogen 2.902 N/A ARG 132.A NE ASP 300.A O no hydrogen 2.859 N/A ARG 132.A NH1 ASN 78.A OD1 no hydrogen 2.973 N/A ARG 132.A NH2 GLU 77.A OE1 no hydrogen 3.028 N/A ARG 132.A NH2 ASP 300.A O no hydrogen 3.052 N/A GLY 133.A N GLN 129.A O no hydrogen 2.967 N/A LEU 134.A N ILE 130.A O no hydrogen 2.815 N/A LYS 135.A N LEU 131.A O no hydrogen 2.853 N/A LYS 135.A NZ GLU 301.A O no hydrogen 2.766 N/A TYR 136.A N ARG 132.A O no hydrogen 3.366 N/A TYR 136.A OH HIS 73.A O no hydrogen 3.363 N/A ILE 137.A N GLY 133.A O no hydrogen 3.119 N/A HIS 138.A N LEU 134.A O no hydrogen 2.913 N/A HIS 138.A NE2 ASP 189.A OD2 no hydrogen 2.821 N/A SER 139.A N LYS 135.A O no hydrogen 3.032 N/A SER 139.A OG LYS 135.A O no hydrogen 3.502 N/A SER 139.A OG TYR 136.A O no hydrogen 2.645 N/A ALA 140.A N ILE 137.A O no hydrogen 3.104 N/A ASP 141.A N HIS 138.A O no hydrogen 2.900 N/A ILE 142.A N ILE 137.A O no hydrogen 3.182 N/A HIS 144.A N ASP 189.A OD2 no hydrogen 2.944 N/A HIS 144.A NE2 LEU 162.A O no hydrogen 2.838 N/A ARG 145.A N ASP 189.A OD1 no hydrogen 2.972 N/A ARG 145.A NE TYR 184.A OH no hydrogen 3.215 N/A ARG 145.A NH2 TYR 184.A OH no hydrogen 3.402 N/A ASP 146.A N HIS 144.A ND1 no hydrogen 3.137 N/A LYS 148.A N ASN 151.A OD1 no hydrogen 3.041 N/A LYS 148.A NZ ASP 146.A OD2 no hydrogen 2.921 N/A LYS 148.A NZ THR 169.A OG1 no hydrogen 2.927 N/A ASN 151.A N LYS 148.A O no hydrogen 3.032 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 2.922 N/A LEU 152.A N PRO 149.A O no hydrogen 3.233 N/A ALA 153.A N LYS 160.A O no hydrogen 2.920 N/A VAL 154.A N ALA 107.A O no hydrogen 2.812 N/A ASN 155.A N GLU 158.A O no hydrogen 2.966 N/A LEU 159.A N GLN 129.A OE1 no hydrogen 2.996 N/A LYS 160.A N ALA 153.A O no hydrogen 2.765 N/A LYS 160.A NZ GLU 77.A O no hydrogen 3.069 N/A ILE 161.A N ASN 78.A O no hydrogen 2.982 N/A LEU 162.A N ASN 151.A O no hydrogen 2.895 N/A THR 169.A OG1 ASP 146.A OD1 no hydrogen 2.270 N/A THR 169.A OG1 ASP 146.A OD2 no hydrogen 2.719 N/A ARG 170.A NE GLY 209.A O no hydrogen 3.044 N/A TRP 171.A N ALA 168.A O no hydrogen 3.405 N/A TRP 171.A NE1 GLY 209.A O no hydrogen 3.123 N/A TYR 172.A N THR 169.A O no hydrogen 3.328 N/A TYR 172.A OH GLU 199.A OE1 no hydrogen 2.536 N/A TYR 172.A OH GLU 199.A OE2 no hydrogen 3.367 N/A ARG 173.A N ARG 170.A O no hydrogen 3.358 N/A ARG 173.A NH1 ARG 145.A O no hydrogen 2.899 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.890 N/A ILE 177.A N ALA 174.A O no hydrogen 3.280 N/A MET 178.A N ALA 174.A O no hydrogen 3.230 N/A LEU 179.A N PRO 175.A O no hydrogen 3.142 N/A HIS 183.A NE2 ASP 278.A OD1 no hydrogen 2.878 N/A ASN 185.A ND2 THR 187.A OG1 no hydrogen 2.441 N/A THR 187.A OG1 SER 277.A O no hydrogen 3.314 N/A VAL 188.A N ASN 185.A O no hydrogen 3.318 N/A ASP 189.A N GLN 186.A O no hydrogen 3.187 N/A TRP 191.A N THR 187.A O no hydrogen 3.136 N/A SER 192.A N VAL 188.A O no hydrogen 3.431 N/A SER 192.A OG TYR 172.A O no hydrogen 2.824 N/A SER 192.A OG VAL 188.A O no hydrogen 3.292 N/A VAL 193.A N ASP 189.A O no hydrogen 2.922 N/A GLY 194.A N ILE 190.A O no hydrogen 3.006 N/A CYS 195.A N TRP 191.A O no hydrogen 3.074 N/A CYS 195.A SG TRP 191.A O no hydrogen 3.347 N/A ILE 196.A N SER 192.A O no hydrogen 2.971 N/A MET 197.A N VAL 193.A O no hydrogen 2.797 N/A ALA 198.A N GLY 194.A O no hydrogen 2.982 N/A GLU 199.A N CYS 195.A O no hydrogen 3.224 N/A LEU 200.A N ILE 196.A O no hydrogen 2.990 N/A LEU 201.A N MET 197.A O no hydrogen 3.181 N/A THR 202.A N ALA 198.A O no hydrogen 2.992 N/A THR 202.A OG1 ALA 198.A O no hydrogen 2.829 N/A THR 202.A OG1 ARG 204.A O no hydrogen 3.176 N/A GLY 203.A N GLU 199.A O no hydrogen 2.804 N/A ARG 204.A N THR 202.A OG1 no hydrogen 3.243 N/A GLY 209.A N PHE 207.A O no hydrogen 3.078 N/A GLY 209.A N GLN 215.A OE1 no hydrogen 3.004 N/A THR 210.A N ASP 214.A OD2 no hydrogen 3.153 N/A THR 210.A OG1 ASP 211.A OD2 no hydrogen 3.264 N/A THR 210.A OG1 ASP 214.A OD2 no hydrogen 3.378 N/A ILE 213.A N ASP 211.A OD1 no hydrogen 3.300 N/A ASP 214.A N ASP 211.A OD1 no hydrogen 3.329 N/A GLN 215.A N ASP 211.A O no hydrogen 2.855 N/A GLN 215.A NE2 TRP 171.A O no hydrogen 3.683 N/A GLN 215.A NE2 PHE 207.A O no hydrogen 3.287 N/A LEU 216.A N HIS 212.A O no hydrogen 3.224 N/A LYS 217.A N ILE 213.A O no hydrogen 3.029 N/A LEU 218.A N ASP 214.A O no hydrogen 2.981 N/A ILE 219.A N GLN 215.A O no hydrogen 3.099 N/A LEU 220.A N LEU 216.A O no hydrogen 2.987 N/A ARG 221.A N LYS 217.A O no hydrogen 3.175 N/A LEU 222.A N ILE 219.A O no hydrogen 3.105 N/A VAL 223.A N ILE 219.A O no hydrogen 2.915 N/A GLY 224.A N LEU 220.A O no hydrogen 2.849 N/A THR 225.A N MET 249.A O no hydrogen 3.126 N/A THR 225.A OG1 MET 249.A O no hydrogen 3.357 N/A LEU 231.A N GLY 227.A O no hydrogen 3.197 N/A LYS 232.A N ALA 228.A O no hydrogen 3.254 N/A LYS 233.A N LEU 230.A O no hydrogen 2.967 N/A LYS 233.A NZ ASP 276.A OD1 no hydrogen 2.954 N/A LYS 233.A NZ ASP 276.A OD2 no hydrogen 2.721 N/A LYS 233.A NZ ASP 278.A OD2 no hydrogen 3.015 N/A ILE 234.A N LEU 231.A O no hydrogen 3.229 N/A ALA 239.A N SER 236.A OG no hydrogen 3.379 N/A ARG 240.A N SER 236.A O no hydrogen 3.271 N/A ARG 240.A NH1 ILE 234.A O no hydrogen 2.867 N/A ASN 241.A N GLU 237.A O no hydrogen 2.990 N/A TYR 242.A N SER 238.A O no hydrogen 3.148 N/A ILE 243.A N ALA 239.A O no hydrogen 3.244 N/A GLN 244.A N ARG 240.A O no hydrogen 3.262 N/A SER 245.A N ASN 241.A O no hydrogen 3.136 N/A SER 245.A OG ASN 241.A O no hydrogen 2.724 N/A LEU 246.A N TYR 242.A O no hydrogen 3.102 N/A MET 249.A N THR 225.A OG1 no hydrogen 3.354 N/A LYS 251.A NZ MET 252.A O no hydrogen 3.130 N/A LYS 251.A NZ GLU 270.A OE2 no hydrogen 3.181 N/A MET 252.A N LEU 222.A O no hydrogen 3.130 N/A VAL 257.A N PHE 254.A O no hydrogen 3.124 N/A PHE 258.A N PHE 254.A O no hydrogen 2.771 N/A ALA 261.A N PHE 258.A O no hydrogen 3.173 N/A ASN 262.A ND2 ASP 120.A OD2 no hydrogen 3.002 N/A LEU 264.A N ASN 262.A OD1 no hydrogen 2.898 N/A VAL 266.A N ASN 262.A O no hydrogen 3.171 N/A ASP 267.A N PRO 263.A O no hydrogen 3.018 N/A LEU 268.A N LEU 264.A O no hydrogen 3.135 N/A LEU 269.A N ALA 265.A O no hydrogen 3.054 N/A GLU 270.A N VAL 266.A O no hydrogen 3.045 N/A LYS 271.A N ASP 267.A O no hydrogen 3.234 N/A LYS 271.A NZ ASP 267.A OD1 no hydrogen 2.877 N/A LYS 271.A NZ ASP 267.A OD2 no hydrogen 3.007 N/A MET 272.A N LEU 268.A O no hydrogen 2.954 N/A MET 272.A N LEU 269.A O no hydrogen 3.185 N/A LEU 273.A N LEU 269.A O no hydrogen 2.928 N/A SER 277.A OG HIS 183.A O no hydrogen 3.233 N/A ASP 278.A N ASP 276.A OD1 no hydrogen 3.095 N/A LYS 279.A N ASP 276.A O no hydrogen 3.024 N/A ARG 280.A NE VAL 274.A O no hydrogen 2.980 N/A ARG 280.A NH1 GLU 176.A OE2 no hydrogen 2.761 N/A ARG 280.A NH1 THR 187.A O no hydrogen 2.967 N/A ARG 280.A NH2 GLU 176.A OE1 no hydrogen 2.995 N/A ARG 280.A NH2 GLU 176.A OE2 no hydrogen 3.342 N/A ARG 280.A NH2 VAL 274.A O no hydrogen 2.995 N/A ILE 281.A N LYS 271.A O no hydrogen 3.238 N/A THR 282.A N GLN 285.A OE1 no hydrogen 3.203 N/A GLN 285.A N THR 282.A OG1 no hydrogen 3.148 N/A ALA 286.A N THR 282.A O no hydrogen 2.894 N/A LEU 287.A N ALA 283.A O no hydrogen 3.020 N/A ALA 288.A N GLN 285.A O no hydrogen 3.293 N/A HIS 289.A N ALA 286.A O no hydrogen 3.059 N/A HIS 289.A NE2 ASP 267.A OD2 no hydrogen 2.543 N/A TYR 291.A N HIS 289.A ND1 no hydrogen 2.981 N/A TYR 291.A OH ASP 120.A OD1 no hydrogen 2.761 N/A PHE 292.A N HIS 289.A O no hydrogen 3.002 N/A ALA 293.A N ALA 290.A O no hydrogen 3.215 N/A TYR 295.A N PHE 292.A O no hydrogen 2.885 N/A TYR 295.A OH ASP 121.A OD2 no hydrogen 2.474 N/A HIS 296.A N PHE 292.A O no hydrogen 2.893 N/A HIS 296.A ND1 GLU 301.A OE2 no hydrogen 2.736 N/A ASP 297.A N GLU 301.A OE2 no hydrogen 3.203 N/A ASP 299.A N ASP 297.A OD1 no hydrogen 3.133 N/A ASP 300.A N ASP 297.A O no hydrogen 3.109 N/A ALA 304.A N SER 139.A OG no hydrogen 2.927 N/A GLN 309.A NE2 ASP 141.A O no hydrogen 2.667 N/A SER 310.A N ASP 308.A OD1 no hydrogen 3.114 N/A SER 310.A OG ASP 308.A OD1 no hydrogen 2.811 N/A GLU 312.A N GLN 309.A O no hydrogen 3.049 N/A SER 313.A N SER 310.A O no hydrogen 3.101 N/A SER 313.A OG SER 310.A O no hydrogen 2.860 N/A ARG 314.A N PHE 311.A O no hydrogen 3.108 N/A LEU 317.A N GLU 320.A OE1 no hydrogen 3.009 N/A TRP 321.A N LEU 317.A O no hydrogen 3.114 N/A LYS 322.A N ILE 318.A O no hydrogen 2.917 N/A LYS 322.A NZ PHE 95.A O no hydrogen 2.673 N/A SER 323.A N ASP 319.A O no hydrogen 3.064 N/A LEU 324.A N GLU 320.A O no hydrogen 3.045 N/A THR 325.A N TRP 321.A O no hydrogen 2.982 N/A THR 325.A OG1 TRP 321.A O no hydrogen 2.978 N/A TYR 326.A N LYS 322.A O no hydrogen 2.915 N/A ASP 327.A N SER 323.A O no hydrogen 3.055 N/A GLU 328.A N LEU 324.A O no hydrogen 3.200 N/A VAL 329.A N THR 325.A O no hydrogen 2.933 N/A ILE 330.A N TYR 326.A O no hydrogen 2.977 N/A SER 331.A N ASP 327.A O no hydrogen 2.901 N/A SER 331.A OG ASP 327.A O no hydrogen 3.219 N/A PHE 332.A N VAL 329.A O no hydrogen 3.505 N/A