Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bak_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH2 THR 87.A O no hydrogen 3.422 N/A TYR 5.A N VAL 16.A O no hydrogen 3.071 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.661 N/A LEU 9.A N THR 12.A O no hydrogen 3.447 N/A THR 12.A N LEU 9.A O no hydrogen 3.181 N/A THR 12.A OG1 ILE 13.A O no hydrogen 3.520 N/A TRP 14.A N GLN 7.A O no hydrogen 2.903 N/A GLU 15.A N TYR 99.A OH no hydrogen 3.192 N/A VAL 16.A N TYR 5.A O no hydrogen 3.239 N/A GLU 18.A N THR 3.A O no hydrogen 2.937 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.988 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 3.291 N/A TYR 20.A N PRO 17.A O no hydrogen 3.046 N/A TYR 20.A OH ASP 84.A OD2 no hydrogen 2.782 N/A GLN 21.A N PHE 38.A O no hydrogen 2.849 N/A GLN 21.A NE2 GLU 18.A O no hydrogen 2.823 N/A SER 24.A N ALA 36.A O no hydrogen 3.144 N/A VAL 26.A N VAL 34.A O no hydrogen 3.117 N/A SER 28.A OG ASN 10.A OD1 no hydrogen 2.939 N/A GLY 29.A N GLY 32.A O no hydrogen 3.372 N/A GLY 32.A N GLY 29.A O no hydrogen 3.466 N/A SER 33.A N LYS 50.A O no hydrogen 3.149 N/A VAL 34.A N GLY 27.A O no hydrogen 3.204 N/A CYS 35.A N VAL 48.A O no hydrogen 2.801 N/A ALA 36.A N SER 24.A O no hydrogen 3.262 N/A ALA 37.A N VAL 46.A O no hydrogen 2.877 N/A PHE 38.A N GLN 21.A O no hydrogen 2.790 N/A ASP 39.A N LEU 44.A O no hydrogen 3.027 N/A THR 40.A N ARG 19.A O no hydrogen 2.990 N/A THR 40.A OG1 ARG 19.A O no hydrogen 2.794 N/A LYS 41.A N ASP 39.A OD1 no hydrogen 3.357 N/A THR 42.A N ASP 39.A O no hydrogen 3.272 N/A THR 42.A OG1 ASP 39.A OD2 no hydrogen 3.400 N/A LEU 44.A N THR 42.A OG1 no hydrogen 3.121 N/A VAL 46.A N ALA 37.A O no hydrogen 2.924 N/A ALA 47.A N THR 102.A O no hydrogen 2.931 N/A VAL 48.A N CYS 35.A O no hydrogen 2.722 N/A LYS 49.A N LEU 100.A O no hydrogen 2.972 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 3.405 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 2.731 N/A LYS 50.A N SER 33.A O no hydrogen 2.834 N/A LYS 50.A NZ THR 12.A OG1 no hydrogen 3.098 N/A LYS 50.A NZ ILE 13.A O no hydrogen 2.803 N/A LEU 51.A N VAL 98.A O no hydrogen 3.103 N/A SER 52.A N TYR 31.A O no hydrogen 3.314 N/A HIS 60.A N SER 57.A OG no hydrogen 3.236 N/A HIS 60.A ND1 ARG 53.A O no hydrogen 2.805 N/A ALA 61.A N SER 57.A O no hydrogen 3.128 N/A LYS 62.A N ILE 58.A O no hydrogen 3.126 N/A LYS 62.A NZ GLU 309.A O no hydrogen 2.755 N/A LYS 62.A NZ ARG 311.A O no hydrogen 3.382 N/A ARG 63.A N ILE 59.A O no hydrogen 3.004 N/A THR 64.A N HIS 60.A O no hydrogen 2.770 N/A THR 64.A OG1 PRO 54.A O no hydrogen 3.194 N/A THR 64.A OG1 HIS 60.A O no hydrogen 2.923 N/A TYR 65.A N ALA 61.A O no hydrogen 3.039 N/A ARG 66.A N LYS 62.A O no hydrogen 2.853 N/A ARG 66.A NE GLU 309.A OE2 no hydrogen 3.064 N/A ARG 66.A NH2 GLU 309.A OE1 no hydrogen 3.038 N/A GLU 67.A N ARG 63.A O no hydrogen 2.994 N/A LEU 68.A N THR 64.A O no hydrogen 3.192 N/A ARG 69.A N TYR 65.A O no hydrogen 2.928 N/A ARG 69.A NH1 TYR 65.A OH no hydrogen 2.815 N/A ARG 69.A NH2 ASP 305.A O no hydrogen 2.727 N/A LEU 70.A N ARG 66.A O no hydrogen 3.122 N/A LEU 71.A N GLU 67.A O no hydrogen 2.976 N/A LYS 72.A N LEU 68.A O no hydrogen 3.159 N/A LYS 72.A NZ GLU 325.A O no hydrogen 3.025 N/A LYS 72.A NZ GLU 325.A OE1 no hydrogen 2.433 N/A HIS 73.A N ARG 69.A O no hydrogen 3.296 N/A HIS 73.A NE2 PRO 303.A O no hydrogen 3.179 N/A MET 74.A N LEU 70.A O no hydrogen 3.338 N/A LYS 75.A N TYR 133.A OH no hydrogen 3.145 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.917 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 3.104 N/A ASN 78.A ND2 LEU 157.A O no hydrogen 3.252 N/A VAL 79.A N HIS 76.A O no hydrogen 3.083 N/A ILE 80.A N ILE 159.A O no hydrogen 3.159 N/A LEU 83.A N VAL 101.A O no hydrogen 2.937 N/A ASP 84.A N VAL 101.A O no hydrogen 3.415 N/A PHE 86.A N TYR 99.A O no hydrogen 3.039 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.924 N/A ALA 89.A N THR 87.A OG1 no hydrogen 3.153 N/A ARG 90.A N GLU 94.A OE1 no hydrogen 2.802 N/A GLU 94.A N SER 91.A OG no hydrogen 3.358 N/A PHE 95.A N LEU 92.A O no hydrogen 3.331 N/A TYR 99.A N PHE 86.A O no hydrogen 3.066 N/A LEU 100.A N LYS 49.A O no hydrogen 3.013 N/A VAL 101.A N ASP 84.A O no hydrogen 2.750 N/A THR 102.A N ALA 47.A O no hydrogen 3.059 N/A THR 102.A OG1 HIS 103.A O no hydrogen 3.430 N/A LEU 104.A N ARG 45.A O no hydrogen 3.196 N/A LEU 109.A N LEU 149.A O no hydrogen 2.921 N/A ASN 111.A N ASP 108.A OD1 no hydrogen 2.828 N/A ILE 112.A N LEU 109.A O no hydrogen 3.370 N/A LYS 114.A NZ THR 199.A O no hydrogen 2.816 N/A VAL 120.A N THR 116.A O no hydrogen 3.194 N/A GLN 121.A N ASP 117.A O no hydrogen 3.139 N/A GLN 121.A NE2 ASP 117.A OD2 no hydrogen 2.906 N/A PHE 122.A N ASP 118.A O no hydrogen 3.206 N/A LEU 123.A N HIS 119.A O no hydrogen 2.978 N/A ILE 124.A N VAL 120.A O no hydrogen 2.948 N/A TYR 125.A N GLN 121.A O no hydrogen 2.890 N/A TYR 125.A OH GLU 298.A OE2 no hydrogen 2.612 N/A GLN 126.A N PHE 122.A O no hydrogen 3.187 N/A GLN 126.A NE2 PHE 122.A O no hydrogen 3.112 N/A GLN 126.A NE2 CYS 155.A O no hydrogen 2.887 N/A ILE 127.A N LEU 123.A O no hydrogen 3.331 N/A LEU 128.A N ILE 124.A O no hydrogen 3.164 N/A ARG 129.A N TYR 125.A O no hydrogen 2.995 N/A ARG 129.A NE ASP 297.A O no hydrogen 2.955 N/A ARG 129.A NH1 ASN 78.A OD1 no hydrogen 2.779 N/A ARG 129.A NH2 GLU 77.A OE1 no hydrogen 3.472 N/A ARG 129.A NH2 GLU 77.A OE2 no hydrogen 3.522 N/A ARG 129.A NH2 ASP 297.A O no hydrogen 3.202 N/A ARG 129.A NH2 ASP 297.A OD1 no hydrogen 3.281 N/A GLY 130.A N GLN 126.A O no hydrogen 3.041 N/A LEU 131.A N ILE 127.A O no hydrogen 2.746 N/A LYS 132.A N LEU 128.A O no hydrogen 2.778 N/A LYS 132.A NZ GLU 298.A O no hydrogen 2.983 N/A TYR 133.A N ARG 129.A O no hydrogen 3.445 N/A TYR 133.A OH HIS 73.A O no hydrogen 3.393 N/A ILE 134.A N GLY 130.A O no hydrogen 3.253 N/A HIS 135.A N LEU 131.A O no hydrogen 2.958 N/A HIS 135.A NE2 ASP 186.A OD2 no hydrogen 2.928 N/A SER 136.A N LYS 132.A O no hydrogen 3.160 N/A SER 136.A OG TYR 133.A O no hydrogen 2.733 N/A ALA 137.A N ILE 134.A O no hydrogen 3.131 N/A ASP 138.A N HIS 135.A O no hydrogen 3.229 N/A ILE 139.A N ILE 134.A O no hydrogen 3.078 N/A HIS 141.A N ASP 186.A OD2 no hydrogen 2.999 N/A HIS 141.A NE2 LEU 160.A O no hydrogen 2.970 N/A ARG 142.A N ASP 186.A OD1 no hydrogen 2.908 N/A ARG 142.A NH2 TYR 181.A OH no hydrogen 3.308 N/A ASP 143.A N HIS 141.A ND1 no hydrogen 3.097 N/A LYS 145.A NZ ASP 143.A OD1 no hydrogen 3.345 N/A LYS 145.A NZ ASP 143.A OD2 no hydrogen 2.745 N/A LYS 145.A NZ THR 166.A OG1 no hydrogen 2.568 N/A ASN 148.A N LYS 145.A O no hydrogen 2.927 N/A LEU 149.A N PRO 146.A O no hydrogen 3.263 N/A ALA 150.A N LYS 158.A O no hydrogen 2.994 N/A VAL 151.A N ALA 107.A O no hydrogen 3.057 N/A ASN 152.A N GLU 156.A O no hydrogen 3.248 N/A ASN 152.A ND2 GLU 156.A OE1 no hydrogen 3.332 N/A CYS 155.A N ASN 152.A O no hydrogen 3.022 N/A CYS 155.A SG HIS 119.A NE2 no hydrogen 3.397 N/A GLU 156.A N ASN 152.A OD1 no hydrogen 3.324 N/A LEU 157.A N GLN 126.A OE1 no hydrogen 2.788 N/A LYS 158.A N ALA 150.A O no hydrogen 2.959 N/A LYS 158.A NZ GLU 77.A O no hydrogen 2.933 N/A ILE 159.A N ASN 78.A O no hydrogen 2.797 N/A LEU 160.A N ASN 148.A O no hydrogen 3.143 N/A THR 166.A OG1 ASP 143.A OD1 no hydrogen 2.781 N/A THR 166.A OG1 ASP 143.A OD2 no hydrogen 3.351 N/A ARG 167.A NE GLY 206.A O no hydrogen 3.183 N/A TRP 168.A N ALA 165.A O no hydrogen 3.290 N/A TRP 168.A NE1 GLY 206.A O no hydrogen 2.903 N/A TYR 169.A N THR 166.A O no hydrogen 3.041 N/A TYR 169.A OH GLU 196.A OE1 no hydrogen 2.386 N/A TYR 169.A OH GLU 196.A OE2 no hydrogen 3.092 N/A ARG 170.A N ARG 167.A O no hydrogen 3.305 N/A ARG 170.A NH1 ARG 142.A O no hydrogen 3.012 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.714 N/A ILE 174.A N ALA 171.A O no hydrogen 3.239 N/A MET 175.A N ALA 171.A O no hydrogen 3.046 N/A HIS 180.A NE2 ASP 275.A OD1 no hydrogen 3.158 N/A ASN 182.A ND2 SER 274.A O no hydrogen 3.110 N/A GLN 183.A N GLN 183.A OE1 no hydrogen 3.328 N/A GLN 183.A NE2 HIS 135.A O no hydrogen 2.786 N/A THR 184.A N ASN 182.A OD1 no hydrogen 2.951 N/A THR 184.A OG1 ASN 182.A OD1 no hydrogen 2.321 N/A THR 184.A OG1 SER 274.A O no hydrogen 3.534 N/A ASP 186.A N GLN 183.A O no hydrogen 3.217 N/A TRP 188.A N THR 184.A O no hydrogen 3.208 N/A SER 189.A OG TYR 169.A O no hydrogen 2.611 N/A VAL 190.A N ASP 186.A O no hydrogen 3.134 N/A GLY 191.A N ILE 187.A O no hydrogen 3.279 N/A CYS 192.A N TRP 188.A O no hydrogen 3.233 N/A CYS 192.A SG TRP 168.A O no hydrogen 4.013 N/A CYS 192.A SG TRP 188.A O no hydrogen 3.684 N/A ILE 193.A N SER 189.A O no hydrogen 2.898 N/A MET 194.A N VAL 190.A O no hydrogen 2.822 N/A ALA 195.A N GLY 191.A O no hydrogen 2.982 N/A GLU 196.A N CYS 192.A O no hydrogen 3.363 N/A LEU 197.A N ILE 193.A O no hydrogen 3.199 N/A LEU 198.A N MET 194.A O no hydrogen 2.967 N/A THR 199.A N ALA 195.A O no hydrogen 2.962 N/A THR 199.A OG1 ALA 195.A O no hydrogen 3.010 N/A GLY 200.A N GLU 196.A O no hydrogen 2.793 N/A GLY 206.A N PHE 204.A O no hydrogen 3.180 N/A GLY 206.A N GLN 212.A OE1 no hydrogen 3.004 N/A THR 207.A N ASP 211.A OD2 no hydrogen 3.071 N/A ASP 211.A N ASP 208.A OD1 no hydrogen 3.093 N/A GLN 212.A N ASP 208.A O no hydrogen 2.986 N/A GLN 212.A NE2 TRP 168.A O no hydrogen 3.616 N/A GLN 212.A NE2 PHE 204.A O no hydrogen 3.004 N/A LEU 213.A N HIS 209.A O no hydrogen 3.368 N/A LYS 214.A N ILE 210.A O no hydrogen 3.028 N/A LEU 215.A N ASP 211.A O no hydrogen 3.104 N/A ILE 216.A N GLN 212.A O no hydrogen 3.150 N/A LEU 217.A N LEU 213.A O no hydrogen 2.904 N/A ARG 218.A N LYS 214.A O no hydrogen 3.036 N/A LEU 219.A N ILE 216.A O no hydrogen 3.042 N/A VAL 220.A N ILE 216.A O no hydrogen 3.010 N/A GLY 221.A N LEU 217.A O no hydrogen 2.905 N/A THR 222.A N MET 246.A O no hydrogen 3.158 N/A THR 222.A OG1 MET 246.A O no hydrogen 3.308 N/A LEU 228.A N GLY 224.A O no hydrogen 2.970 N/A LYS 229.A N ALA 225.A O no hydrogen 3.083 N/A LYS 230.A N LEU 227.A O no hydrogen 3.112 N/A LYS 230.A NZ ASP 273.A OD1 no hydrogen 3.256 N/A LYS 230.A NZ ASP 273.A OD2 no hydrogen 2.789 N/A LYS 230.A NZ ASP 275.A OD2 no hydrogen 2.604 N/A ILE 231.A N LEU 228.A O no hydrogen 3.406 N/A ARG 237.A N SER 233.A O no hydrogen 3.446 N/A ARG 237.A NH1 ILE 231.A O no hydrogen 3.038 N/A ARG 237.A NH1 SER 232.A O no hydrogen 3.533 N/A ASN 238.A N GLU 234.A O no hydrogen 3.073 N/A TYR 239.A N SER 235.A O no hydrogen 3.094 N/A ILE 240.A N ALA 236.A O no hydrogen 3.224 N/A GLN 241.A N ARG 237.A O no hydrogen 3.214 N/A SER 242.A N ASN 238.A O no hydrogen 2.818 N/A SER 242.A N TYR 239.A O no hydrogen 3.055 N/A SER 242.A OG ASN 238.A O no hydrogen 3.296 N/A SER 242.A OG TYR 239.A O no hydrogen 2.424 N/A LEU 243.A N ILE 240.A O no hydrogen 3.373 N/A LYS 248.A NZ MET 249.A O no hydrogen 3.328 N/A LYS 248.A NZ GLU 267.A OE2 no hydrogen 3.022 N/A MET 249.A N LEU 219.A O no hydrogen 3.160 N/A ALA 252.A N ASN 250.A OD1 no hydrogen 3.358 N/A VAL 254.A N PHE 251.A O no hydrogen 3.060 N/A PHE 255.A N PHE 251.A O no hydrogen 2.877 N/A ALA 258.A N PHE 255.A O no hydrogen 3.013 N/A ASN 259.A ND2 ASP 117.A OD2 no hydrogen 3.071 N/A LEU 261.A N ASN 259.A OD1 no hydrogen 3.219 N/A VAL 263.A N ASN 259.A O no hydrogen 3.144 N/A ASP 264.A N PRO 260.A O no hydrogen 3.044 N/A LEU 265.A N LEU 261.A O no hydrogen 3.085 N/A LEU 266.A N ALA 262.A O no hydrogen 3.016 N/A GLU 267.A N VAL 263.A O no hydrogen 3.186 N/A LYS 268.A N ASP 264.A O no hydrogen 3.241 N/A LYS 268.A NZ ASP 264.A OD1 no hydrogen 3.403 N/A LYS 268.A NZ ASP 264.A OD2 no hydrogen 3.218 N/A MET 269.A N LEU 265.A O no hydrogen 3.082 N/A MET 269.A N LEU 266.A O no hydrogen 3.276 N/A LEU 270.A N LEU 266.A O no hydrogen 3.003 N/A SER 274.A OG HIS 180.A O no hydrogen 3.301 N/A ASP 275.A N ASP 273.A OD1 no hydrogen 2.986 N/A LYS 276.A NZ GLU 226.A OE2 no hydrogen 3.423 N/A ARG 277.A NE VAL 271.A O no hydrogen 3.024 N/A ARG 277.A NH1 GLU 173.A OE2 no hydrogen 2.817 N/A ARG 277.A NH1 THR 184.A O no hydrogen 3.040 N/A ARG 277.A NH2 GLU 173.A OE1 no hydrogen 3.039 N/A ARG 277.A NH2 GLU 173.A OE2 no hydrogen 3.399 N/A ARG 277.A NH2 VAL 271.A O no hydrogen 3.055 N/A ARG 277.A NH2 LEU 272.A O no hydrogen 3.265 N/A ILE 278.A N LYS 268.A O no hydrogen 3.203 N/A THR 279.A N GLN 282.A OE1 no hydrogen 3.275 N/A GLN 282.A N THR 279.A OG1 no hydrogen 3.294 N/A ALA 283.A N THR 279.A O no hydrogen 3.034 N/A LEU 284.A N ALA 280.A O no hydrogen 3.108 N/A ALA 285.A N GLN 282.A O no hydrogen 3.206 N/A HIS 286.A N ALA 283.A O no hydrogen 3.308 N/A HIS 286.A NE2 ASP 264.A OD2 no hydrogen 2.730 N/A TYR 288.A N HIS 286.A ND1 no hydrogen 3.184 N/A TYR 288.A OH ASP 117.A OD1 no hydrogen 3.289 N/A PHE 289.A N HIS 286.A O no hydrogen 3.199 N/A ALA 290.A N ALA 287.A O no hydrogen 3.418 N/A TYR 292.A N PHE 289.A O no hydrogen 3.115 N/A TYR 292.A OH ASP 118.A OD2 no hydrogen 2.750 N/A HIS 293.A N PHE 289.A O no hydrogen 2.962 N/A ASP 294.A N GLU 298.A OE2 no hydrogen 3.205 N/A ASP 296.A N ASP 294.A OD1 no hydrogen 2.895 N/A ASP 297.A N ASP 294.A O no hydrogen 2.938 N/A ALA 301.A N SER 136.A OG no hydrogen 2.975 N/A SER 307.A N ASP 305.A OD1 no hydrogen 3.287 N/A SER 307.A OG ASP 305.A OD1 no hydrogen 3.279 N/A GLU 309.A N GLN 306.A O no hydrogen 3.267 N/A SER 310.A N SER 307.A O no hydrogen 3.078 N/A SER 310.A OG SER 307.A O no hydrogen 3.002 N/A ARG 311.A N PHE 308.A O no hydrogen 3.112 N/A ARG 311.A NH1 SER 307.A OG no hydrogen 2.812 N/A LEU 314.A N GLU 317.A OE1 no hydrogen 2.938 N/A GLU 317.A N LEU 314.A O no hydrogen 3.150 N/A TRP 318.A N LEU 314.A O no hydrogen 3.291 N/A LYS 319.A N ILE 315.A O no hydrogen 2.911 N/A SER 320.A N ASP 316.A O no hydrogen 3.080 N/A LEU 321.A N GLU 317.A O no hydrogen 3.063 N/A THR 322.A N TRP 318.A O no hydrogen 2.986 N/A THR 322.A OG1 TRP 318.A O no hydrogen 2.919 N/A TYR 323.A N LYS 319.A O no hydrogen 3.042 N/A ASP 324.A N SER 320.A O no hydrogen 3.199 N/A GLU 325.A N LEU 321.A O no hydrogen 3.279 N/A VAL 326.A N THR 322.A O no hydrogen 3.001 N/A ILE 327.A N TYR 323.A O no hydrogen 3.036 N/A SER 328.A N ASP 324.A O no hydrogen 3.015 N/A SER 328.A OG ASP 324.A O no hydrogen 2.915 N/A PHE 329.A N VAL 326.A O no hydrogen 3.224 N/A