Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bgw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASN 1.A OD1 no hydrogen 2.954 N/A GLN 6.A N GLU 2.A O no hydrogen 2.901 N/A ALA 7.A N TYR 3.A O no hydrogen 3.296 N/A VAL 8.A N ALA 4.A O no hydrogen 3.046 N/A LEU 9.A N GLU 5.A O no hydrogen 3.080 N/A GLY 10.A N GLN 6.A O no hydrogen 2.706 N/A SER 11.A N ALA 7.A O no hydrogen 2.854 N/A SER 11.A OG ALA 7.A O no hydrogen 2.733 N/A SER 11.A OG VAL 8.A O no hydrogen 3.103 N/A ILE 12.A N VAL 8.A O no hydrogen 3.215 N/A LEU 13.A N LEU 9.A O no hydrogen 3.115 N/A THR 14.A N SER 11.A O no hydrogen 3.256 N/A GLU 15.A N SER 11.A O no hydrogen 2.738 N/A GLU 17.A N GLU 15.A O no hydrogen 2.255 N/A LEU 18.A N GLU 15.A O no hydrogen 2.725 N/A LYS 20.A NZ ASP 45.A OD2 no hydrogen 3.380 N/A CYS 22.A N LEU 18.A O no hydrogen 3.169 N/A HIS 28.A N THR 25.A O no hydrogen 2.761 N/A PHE 29.A N PRO 26.A O no hydrogen 2.819 N/A SER 30.A N GLU 5.A OE1 no hydrogen 3.245 N/A SER 30.A N GLU 5.A OE2 no hydrogen 2.886 N/A SER 30.A OG GLU 5.A OE1 no hydrogen 2.551 N/A SER 30.A OG GLU 5.A OE2 no hydrogen 3.402 N/A ASN 36.A N GLY 32.A O no hydrogen 2.792 N/A ASN 36.A ND2 GLN 66.A O no hydrogen 3.207 N/A ILE 37.A N LYS 33.A O no hydrogen 2.675 N/A TYR 38.A N HIS 34.A O no hydrogen 3.243 N/A TYR 38.A N PHE 35.A O no hydrogen 3.085 N/A PHE 39.A N PHE 35.A O no hydrogen 2.874 N/A THR 40.A N ASN 36.A O no hydrogen 3.111 N/A THR 40.A OG1 ASN 36.A O no hydrogen 2.568 N/A GLN 42.A N TYR 38.A O no hydrogen 2.507 N/A ASP 43.A N PHE 39.A O no hydrogen 3.023 N/A LEU 44.A N THR 40.A O no hydrogen 3.441 N/A ASP 45.A N GLN 42.A O no hydrogen 2.751 N/A ARG 46.A N GLN 42.A O no hydrogen 3.024 N/A LYS 47.A N ASP 43.A O no hydrogen 3.012 N/A GLY 48.A N ASP 45.A O no hydrogen 3.145 N/A GLN 49.A N LEU 44.A O no hydrogen 2.993 N/A THR 54.A OG1 ASP 52.A OD2 no hydrogen 3.136 N/A SER 55.A N ASP 52.A OD1 no hydrogen 3.171 N/A SER 55.A OG SER 50.A O no hydrogen 3.033 N/A ILE 56.A N ASP 52.A O no hydrogen 2.768 N/A ALA 57.A N PHE 53.A O no hydrogen 2.905 N/A ALA 58.A N THR 54.A O no hydrogen 3.008 N/A ARG 59.A N SER 55.A O no hydrogen 2.791 N/A VAL 60.A N ILE 56.A O no hydrogen 3.275 N/A GLY 61.A N ARG 59.A O no hydrogen 2.896 N/A LEU 67.A N LEU 64.A O no hydrogen 2.919 N/A GLY 68.A N PRO 65.A O no hydrogen 2.986 N/A TYR 72.A N GLY 69.A O no hydrogen 3.175 N/A THR 74.A N PHE 70.A O no hydrogen 3.288 N/A THR 74.A OG1 PHE 70.A O no hydrogen 3.179 N/A THR 74.A OG1 GLY 71.A O no hydrogen 2.759 N/A GLU 75.A N GLY 71.A O no hydrogen 3.250 N/A LEU 76.A N TYR 72.A O no hydrogen 2.816 N/A ALA 77.A N LEU 73.A O no hydrogen 2.994 N/A ALA 78.A N THR 74.A O no hydrogen 2.916 N/A SER 79.A N GLU 75.A O no hydrogen 2.970 N/A SER 79.A N LEU 76.A O no hydrogen 3.009 N/A SER 82.A OG THR 84.A OG1 no hydrogen 2.590 N/A THR 84.A OG1 SER 82.A OG no hydrogen 2.590 N/A THR 85.A N SER 82.A O no hydrogen 3.501 N/A HIS 89.A N THR 85.A O no hydrogen 2.882 N/A CYS 90.A N PHE 86.A O no hydrogen 2.756 N/A GLN 91.A N LYS 87.A O no hydrogen 2.926 N/A GLN 91.A N GLN 88.A O no hydrogen 3.277 N/A THR 92.A N GLN 88.A O no hydrogen 3.058 N/A THR 92.A OG1 GLN 88.A O no hydrogen 3.101 N/A VAL 93.A N HIS 89.A O no hydrogen 2.769 N/A GLU 95.A N GLN 91.A O no hydrogen 2.620 N/A TYR 96.A N THR 92.A O no hydrogen 3.204 N/A PHE 97.A N SER 94.A O no hydrogen 2.908 N/A GLN 98.A N SER 94.A O no hydrogen 3.211 N/A LYS 99.A N GLU 95.A O no hydrogen 3.141 N/A ARG 100.A N TYR 96.A O no hydrogen 2.986 N/A LYS 101.A N PHE 97.A O no hydrogen 3.080 N/A ALA 102.A N GLN 98.A O no hydrogen 2.600 N/A ILE 103.A N LYS 99.A O no hydrogen 3.317 N/A SER 104.A N ARG 100.A O no hydrogen 3.271 N/A ILE 105.A N LYS 101.A O no hydrogen 2.640 N/A ALA 106.A N ILE 103.A O no hydrogen 2.809 N/A GLN 107.A N ILE 103.A O no hydrogen 2.756 N/A GLN 108.A NE2 SER 104.A O no hydrogen 2.986 N/A ILE 109.A N ALA 106.A O no hydrogen 3.045 N/A ASN 112.A N GLN 108.A O no hydrogen 2.936 N/A ASN 112.A ND2 GLN 108.A O no hydrogen 2.785 N/A VAL 113.A N ILE 109.A O no hydrogen 2.829 N/A VAL 122.A N ILE 118.A O no hydrogen 3.104 N/A SER 123.A N GLN 119.A O no hydrogen 2.780 N/A GLU 124.A N GLU 120.A O no hydrogen 2.644 N/A LEU 125.A N VAL 122.A O no hydrogen 3.124 N/A MET 126.A N VAL 122.A O no hydrogen 3.232 N/A GLU 127.A N SER 123.A O no hydrogen 3.507 N/A GLU 129.A N LEU 125.A O no hydrogen 3.179 N/A ALA 130.A N MET 126.A O no hydrogen 2.933 N/A SER 131.A OG GLU 127.A O no hydrogen 3.443 N/A SER 139.A OG GLY 138.A O no hydrogen 2.895 N/A ALA 143.A N ILE 140.A O no hydrogen 2.930 N/A VAL 145.A N ASP 141.A O no hydrogen 3.171 N/A THR 146.A OG1 GLU 142.A O no hydrogen 3.230 N/A VAL 147.A N ALA 143.A O no hydrogen 2.548 N/A TYR 148.A N VAL 145.A O no hydrogen 3.219 N/A GLU 149.A N VAL 145.A O no hydrogen 2.898 N/A GLU 150.A N THR 146.A O no hydrogen 3.336 N/A ILE 151.A N TYR 148.A O no hydrogen 2.911 N/A SER 153.A OG GLU 149.A O no hydrogen 2.893 N/A THR 159.A N TYR 173.A O no hydrogen 3.150 N/A GLY 160.A N TYR 173.A O no hydrogen 2.908 N/A VAL 161.A N TYR 175.A O no hydrogen 3.010 N/A SER 163.A N ASP 169.A OD1 no hydrogen 2.787 N/A SER 163.A N ASP 169.A OD2 no hydrogen 3.124 N/A SER 163.A OG ASP 169.A OD1 no hydrogen 2.644 N/A GLY 164.A N ASP 169.A OD2 no hydrogen 3.327 N/A PHE 165.A N SER 163.A OG no hydrogen 3.206 N/A LEU 168.A N PHE 165.A O no hydrogen 2.659 N/A ASP 169.A N PHE 165.A O no hydrogen 3.074 N/A MET 171.A N LEU 168.A O no hydrogen 2.930 N/A THR 172.A N LEU 168.A O no hydrogen 3.323 N/A TYR 173.A N ASP 169.A O no hydrogen 2.906 N/A GLY 174.A N THR 172.A OG1 no hydrogen 3.067 N/A ARG 177.A NH1 ASP 331.A OD2 no hydrogen 3.219 N/A VAL 181.A N VAL 334.A O no hydrogen 2.888 N/A LEU 182.A N ILE 369.A O no hydrogen 3.058 N/A ILE 183.A N ALA 336.A O no hydrogen 3.060 N/A ALA 184.A N GLU 371.A O no hydrogen 3.261 N/A ALA 185.A N SER 338.A O no hydrogen 3.394 N/A ARG 186.A NE GLU 345.A OE2 no hydrogen 3.102 N/A ARG 186.A NH1 LEU 340.A O no hydrogen 3.137 N/A ARG 186.A NH2 GLU 345.A OE2 no hydrogen 3.079 N/A PHE 194.A N GLY 190.A O no hydrogen 2.665 N/A LEU 196.A N THR 192.A O no hydrogen 2.849 N/A LYS 197.A NZ ASN 414.A OD1 no hydrogen 3.390 N/A GLN 198.A N PHE 194.A O no hydrogen 3.373 N/A GLN 198.A NE2 TYR 175.A OH no hydrogen 2.852 N/A ALA 199.A N ALA 195.A O no hydrogen 2.788 N/A ASN 201.A N LYS 197.A O no hydrogen 3.062 N/A MET 202.A N GLN 198.A O no hydrogen 3.080 N/A SER 203.A N ALA 199.A O no hydrogen 3.286 N/A ASP 204.A N LYS 200.A O no hydrogen 2.765 N/A ASN 205.A N ASN 201.A O no hydrogen 3.269 N/A ASP 207.A N MET 202.A O no hydrogen 2.978 N/A VAL 208.A N ARG 292.A O no hydrogen 3.103 N/A VAL 209.A N ASN 263.A O no hydrogen 3.219 N/A ASN 210.A N ILE 294.A O no hydrogen 2.736 N/A ASN 210.A ND2 LYS 280.A O no hydrogen 3.683 N/A ASN 210.A ND2 THR 284.A OG1 no hydrogen 3.028 N/A LEU 211.A N ASN 265.A O no hydrogen 2.689 N/A HIS 212.A N MET 296.A O no hydrogen 2.984 N/A SER 213.A N PHE 267.A O no hydrogen 3.151 N/A SER 213.A OG MET 216.A O no hydrogen 3.292 N/A ASN 221.A N GLY 217.A O no hydrogen 3.317 N/A LYS 223.A N LYS 219.A O no hydrogen 2.696 N/A ARG 224.A N GLU 220.A O no hydrogen 2.846 N/A LEU 225.A N ASN 221.A O no hydrogen 3.202 N/A ILE 226.A N ILE 222.A O no hydrogen 2.884 N/A VAL 227.A N LYS 223.A O no hydrogen 3.225 N/A THR 228.A N ARG 224.A O no hydrogen 3.027 N/A THR 228.A OG1 ARG 224.A O no hydrogen 2.883 N/A THR 228.A OG1 TYR 412.A O no hydrogen 2.812 N/A THR 228.A OG1 GLY 413.A O no hydrogen 3.315 N/A ALA 229.A N LEU 225.A O no hydrogen 3.202 N/A ALA 229.A N ILE 226.A O no hydrogen 2.867 N/A GLY 230.A N ILE 226.A O no hydrogen 3.015 N/A ALA 234.A N GLU 411.A O no hydrogen 3.037 N/A GLN 235.A N ASN 233.A OD1 no hydrogen 3.138 N/A LYS 236.A NZ ASP 248.A OD2 no hydrogen 3.250 N/A ARG 241.A N LYS 236.A O no hydrogen 2.743 N/A PHE 244.A N ARG 241.A O no hydrogen 3.027 N/A ALA 245.A N ARG 241.A O no hydrogen 3.024 N/A LYS 251.A NZ ASP 248.A OD1 no hydrogen 3.135 N/A LEU 252.A N ASP 248.A O no hydrogen 2.713 N/A SER 253.A N TRP 249.A O no hydrogen 2.738 N/A SER 253.A OG TRP 249.A O no hydrogen 2.959 N/A ALA 255.A N LYS 251.A O no hydrogen 3.158 N/A ILE 256.A N LEU 252.A O no hydrogen 3.023 N/A GLU 258.A N MET 254.A O no hydrogen 3.054 N/A ILE 259.A N ALA 255.A O no hydrogen 2.971 N/A SER 260.A N ILE 256.A O no hydrogen 3.397 N/A SER 260.A OG ILE 256.A O no hydrogen 2.830 N/A SER 260.A OG GLY 257.A O no hydrogen 2.824 N/A ASN 261.A N GLY 257.A O no hydrogen 2.799 N/A ASN 261.A N GLU 258.A O no hydrogen 3.166 N/A SER 262.A OG ILE 259.A O no hydrogen 2.397 N/A ASN 263.A N SER 203.A OG no hydrogen 2.583 N/A ASN 265.A N VAL 209.A O no hydrogen 2.872 N/A ASN 265.A ND2 ILE 264.A O no hydrogen 2.969 N/A PHE 267.A N LEU 211.A O no hydrogen 2.986 N/A LYS 269.A NZ GLY 271.A O no hydrogen 3.075 N/A GLN 272.A NE2 PHE 267.A O no hydrogen 3.669 N/A GLN 272.A NE2 LYS 269.A O no hydrogen 3.220 N/A TYR 276.A N SER 273.A O no hydrogen 2.728 N/A TYR 276.A N SER 273.A OG no hydrogen 3.029 N/A ILE 277.A N SER 273.A O no hydrogen 3.139 N/A TRP 278.A N VAL 274.A O no hydrogen 3.047 N/A SER 279.A N ASN 275.A O no hydrogen 3.055 N/A LYS 280.A N TYR 276.A O no hydrogen 3.073 N/A THR 281.A N ILE 277.A O no hydrogen 2.900 N/A THR 281.A N TRP 278.A O no hydrogen 2.968 N/A THR 281.A OG1 ILE 277.A O no hydrogen 2.779 N/A ARG 282.A N TRP 278.A O no hydrogen 3.058 N/A GLN 283.A N SER 279.A O no hydrogen 3.112 N/A THR 284.A N LYS 280.A O no hydrogen 3.198 N/A THR 284.A OG1 LYS 280.A O no hydrogen 2.828 N/A LYS 285.A N THR 281.A O no hydrogen 2.860 N/A ARG 286.A N ARG 282.A O no hydrogen 2.664 N/A LYS 287.A N GLN 283.A O no hydrogen 2.931 N/A ASN 288.A N THR 284.A O no hydrogen 3.105 N/A LYS 291.A NZ ASP 206.A OD1 no hydrogen 3.183 N/A ARG 292.A NE ASP 207.A OD1 no hydrogen 3.027 N/A ARG 292.A NH1 THR 159.A O no hydrogen 3.383 N/A ARG 292.A NH2 ASP 207.A OD1 no hydrogen 3.219 N/A ARG 292.A NH2 ASP 207.A OD2 no hydrogen 2.628 N/A ILE 294.A N VAL 208.A O no hydrogen 2.665 N/A VAL 295.A N VAL 333.A O no hydrogen 2.787 N/A MET 296.A N ASN 210.A O no hydrogen 2.813 N/A ILE 297.A N ILE 335.A O no hydrogen 2.903 N/A ASP 298.A N HIS 212.A O no hydrogen 2.944 N/A TYR 299.A N ILE 297.A O no hydrogen 2.907 N/A LEU 300.A N LEU 337.A O no hydrogen 2.715 N/A GLN 301.A NE2 SER 338.A OG no hydrogen 3.154 N/A GLU 304.A N GLN 272.A O no hydrogen 2.828 N/A ALA 306.A N GLN 318.A OE1 no hydrogen 2.914 N/A ASP 310.A N ALA 308.A O no hydrogen 3.077 N/A SER 311.A N ASP 310.A OD1 no hydrogen 2.696 N/A ARG 312.A NH1 GLN 315.A OE1 no hydrogen 3.338 N/A ARG 312.A NH2 GLN 301.A O no hydrogen 3.376 N/A ASN 314.A N SER 311.A O no hydrogen 2.931 N/A GLN 315.A N SER 311.A O no hydrogen 3.070 N/A GLN 315.A N ARG 312.A O no hydrogen 2.974 N/A GLN 315.A NE2 LYS 307.A O no hydrogen 3.520 N/A ILE 316.A N ARG 312.A O no hydrogen 3.222 N/A SER 317.A OG THR 313.A O no hydrogen 3.071 N/A GLN 318.A N ASN 314.A O no hydrogen 2.800 N/A ILE 319.A N GLN 315.A O no hydrogen 2.775 N/A SER 320.A N ILE 316.A O no hydrogen 2.878 N/A SER 320.A OG GLN 362.A O no hydrogen 3.153 N/A ARG 321.A N SER 317.A O no hydrogen 2.829 N/A ASP 322.A N GLN 318.A O no hydrogen 3.248 N/A LEU 323.A N ILE 319.A O no hydrogen 2.734 N/A LYS 324.A N SER 320.A O no hydrogen 3.110 N/A LYS 324.A NZ ASP 368.A OD2 no hydrogen 3.105 N/A LYS 325.A N ARG 321.A O no hydrogen 3.180 N/A MET 326.A N ASP 322.A O no hydrogen 3.023 N/A ALA 327.A N LEU 323.A O no hydrogen 3.263 N/A ARG 328.A N LYS 324.A O no hydrogen 2.971 N/A GLU 329.A N LYS 325.A O no hydrogen 2.766 N/A LEU 330.A N MET 326.A O no hydrogen 2.799 N/A VAL 332.A N ALA 327.A O no hydrogen 3.340 N/A VAL 333.A N VAL 293.A O no hydrogen 3.218 N/A VAL 334.A N ASN 179.A O no hydrogen 3.284 N/A ILE 335.A N VAL 295.A O no hydrogen 2.866 N/A ALA 336.A N VAL 181.A O no hydrogen 3.125 N/A LEU 337.A N ILE 297.A O no hydrogen 2.787 N/A SER 338.A N ILE 183.A O no hydrogen 2.910 N/A SER 338.A OG GLN 339.A O no hydrogen 3.300 N/A SER 341.A N ASP 356.A O no hydrogen 2.901 N/A VAL 344.A N SER 341.A O no hydrogen 3.103 N/A GLN 346.A N GLN 343.A O no hydrogen 3.387 N/A ARG 347.A NH2 ASP 356.A OD2 no hydrogen 2.862 N/A LYS 350.A NZ GLU 345.A O no hydrogen 2.923 N/A LYS 350.A NZ ARG 347.A O no hydrogen 2.887 N/A MET 353.A N ASP 356.A OD2 no hydrogen 2.966 N/A ASP 356.A N MET 353.A O no hydrogen 3.292 N/A LEU 357.A N LEU 354.A O no hydrogen 3.041 N/A SER 360.A N GLU 359.A OE1 no hydrogen 2.718 N/A SER 360.A OG GLU 359.A OE1 no hydrogen 3.491 N/A ASP 366.A N LEU 363.A O no hydrogen 2.831 N/A ALA 367.A N LEU 363.A O no hydrogen 3.114 N/A ASP 368.A N PHE 180.A O no hydrogen 2.822 N/A GLU 371.A N LEU 182.A O no hydrogen 2.688 N/A PHE 372.A N ILE 392.A O no hydrogen 2.860 N/A LEU 373.A N ALA 184.A O no hydrogen 3.137 N/A TYR 374.A OH ASP 376.A OD1 no hydrogen 2.739 N/A ASP 377.A N ASP 377.A OD1 no hydrogen 2.595 N/A ASP 380.A N ASP 376.A O no hydrogen 3.176 N/A GLU 382.A N ASP 380.A OD1 no hydrogen 3.404 N/A ASN 387.A ND2 ASP 377.A OD2 no hydrogen 3.305 N/A VAL 389.A N LEU 406.A O no hydrogen 2.998 N/A GLU 390.A N TYR 374.A O no hydrogen 2.877 N/A ILE 392.A N PHE 372.A O no hydrogen 2.738 N/A ILE 393.A N GLY 402.A O no hydrogen 3.144 N/A ALA 394.A N ILE 370.A O no hydrogen 2.934 N/A LYS 395.A N ILE 370.A O no hydrogen 3.416 N/A LYS 395.A NZ GLU 364.A O no hydrogen 2.638 N/A LYS 395.A NZ ALA 367.A O no hydrogen 2.819 N/A ARG 397.A N ASP 368.A O no hydrogen 3.180 N/A GLY 402.A N ILE 393.A O no hydrogen 3.333 N/A VAL 404.A N VAL 391.A O no hydrogen 2.710 N/A LEU 406.A N VAL 389.A O no hydrogen 2.832 N/A ALA 407.A N VAL 416.A O no hydrogen 2.998 N/A PHE 408.A N ASN 387.A O no hydrogen 3.089 N/A ILE 409.A N ASN 414.A O no hydrogen 2.847 N/A LYS 410.A NZ ASP 377.A OD2 no hydrogen 3.187 N/A TYR 412.A N ILE 409.A O no hydrogen 3.052 N/A GLY 413.A N ILE 409.A O no hydrogen 2.926 N/A VAL 416.A N ALA 407.A O no hydrogen 2.810 N/A