Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qbw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLN 22.A O no hydrogen 2.563 N/A ARG 2.A NE GLU 21.A OE1 no hydrogen 3.273 N/A TYR 3.A N ILE 20.A O no hydrogen 3.075 N/A LEU 4.A N ALA 89.A O no hydrogen 2.948 N/A GLY 5.A N VAL 18.A O no hydrogen 2.829 N/A LEU 6.A N GLY 91.A O no hydrogen 2.869 N/A MET 7.A N ASP 16.A O no hydrogen 2.826 N/A SER 8.A OG GLN 95.A OE1 no hydrogen 2.619 N/A LEU 12.A N GLY 9.A O no hydrogen 3.361 N/A MET 15.A N LEU 34.A O no hydrogen 2.751 N/A ASP 16.A N MET 7.A O no hydrogen 2.732 N/A ILE 17.A N HIS 32.A O no hydrogen 2.812 N/A VAL 18.A N GLY 5.A O no hydrogen 2.883 N/A LEU 19.A N ALA 30.A O no hydrogen 2.740 N/A ILE 20.A N TYR 3.A O no hydrogen 3.008 N/A GLU 21.A N THR 27.A O no hydrogen 2.832 N/A GLN 22.A N PRO 1.A O no hydrogen 2.616 N/A GLN 22.A NE2 GLY 23.A O no hydrogen 3.323 N/A GLY 23.A N ARG 25.A O no hydrogen 3.029 N/A THR 26.A OG1 GLN 22.A OE1 no hydrogen 2.464 N/A THR 27.A N GLU 21.A O no hydrogen 3.013 N/A LEU 29.A N LEU 19.A O no hydrogen 2.738 N/A ALA 30.A N LEU 19.A O no hydrogen 3.283 N/A HIS 32.A N ILE 17.A O no hydrogen 2.743 N/A HIS 32.A NE2 GLU 75.A OE1 no hydrogen 2.876 N/A TYR 33.A OH ASP 13.A OD2 no hydrogen 2.711 N/A LEU 34.A N MET 15.A O no hydrogen 3.036 N/A MET 36.A N ASP 13.A O no hydrogen 3.130 N/A ARG 41.A N PRO 37.A O no hydrogen 2.923 N/A ARG 41.A NE LEU 12.A O no hydrogen 3.270 N/A GLU 42.A N ALA 38.A O no hydrogen 3.020 N/A ASP 43.A N GLY 39.A O no hydrogen 3.111 N/A ILE 44.A N LEU 40.A O no hydrogen 3.009 N/A LEU 45.A N ARG 41.A O no hydrogen 3.031 N/A ALA 46.A N GLU 42.A O no hydrogen 2.974 N/A LEU 47.A N ILE 44.A O no hydrogen 2.912 N/A CYS 48.A N LEU 45.A O no hydrogen 3.137 N/A CYS 48.A SG ILE 44.A O no hydrogen 3.472 N/A CYS 48.A SG THR 96.A O no hydrogen 4.031 N/A CYS 48.A SG ILE 97.A O no hydrogen 3.866 N/A ARG 57.A N ASP 53.A O no hydrogen 3.003 N/A ARG 57.A NH1 PRO 52.A O no hydrogen 2.877 N/A ARG 57.A NH2 ALA 46.A O no hydrogen 3.169 N/A ALA 58.A N GLU 54.A O no hydrogen 2.697 N/A ALA 59.A N ILE 55.A O no hydrogen 3.121 N/A GLU 60.A N ALA 56.A O no hydrogen 3.065 N/A VAL 61.A N ARG 57.A O no hydrogen 2.953 N/A GLU 62.A N ALA 58.A O no hydrogen 2.909 N/A GLN 63.A N ALA 59.A O no hydrogen 3.186 N/A ARG 64.A N GLU 60.A O no hydrogen 3.393 N/A ARG 64.A NH2 ASP 43.A OD2 no hydrogen 2.446 N/A TRP 65.A N VAL 61.A O no hydrogen 2.862 N/A VAL 66.A N GLU 62.A O no hydrogen 2.849 N/A ALA 67.A N GLN 63.A O no hydrogen 2.984 N/A LEU 68.A N ARG 64.A O no hydrogen 2.999 N/A ALA 69.A N TRP 65.A O no hydrogen 2.945 N/A ALA 70.A N VAL 66.A O no hydrogen 2.848 N/A GLN 71.A N ALA 67.A O no hydrogen 2.943 N/A GLN 71.A NE2 GLU 75.A OE2 no hydrogen 2.729 N/A GLY 72.A N LEU 68.A O no hydrogen 2.949 N/A VAL 73.A N ALA 69.A O no hydrogen 2.934 N/A ARG 74.A N ALA 70.A O no hydrogen 2.936 N/A GLU 75.A N GLN 71.A O no hydrogen 3.031 N/A LEU 76.A N GLY 72.A O no hydrogen 2.977 N/A LEU 77.A N VAL 73.A O no hydrogen 2.955 N/A LEU 78.A N ARG 74.A O no hydrogen 2.934 N/A GLN 79.A N GLU 75.A O no hydrogen 2.912 N/A GLN 80.A N LEU 76.A O no hydrogen 3.019 N/A GLN 81.A N LEU 78.A O no hydrogen 3.035 N/A MET 82.A N LEU 77.A O no hydrogen 2.916 N/A SER 83.A N GLU 86.A OE2 no hydrogen 3.054 N/A SER 83.A OG ASP 85.A OD2 no hydrogen 3.347 N/A GLU 86.A N SER 83.A O no hydrogen 3.140 N/A VAL 87.A N PRO 84.A O no hydrogen 3.025 N/A ARG 88.A N ARG 2.A O no hydrogen 2.846 N/A ARG 88.A NH1 TYR 3.A OH no hydrogen 2.609 N/A ARG 88.A NH1 GLU 324.A OE2 no hydrogen 2.811 N/A ARG 88.A NH2 GLU 324.A OE2 no hydrogen 3.548 N/A ILE 90.A N ASP 122.A O no hydrogen 2.761 N/A GLY 91.A N LEU 4.A O no hydrogen 2.661 N/A SER 92.A N VAL 124.A O no hydrogen 2.770 N/A HIS 93.A N LEU 6.A O no hydrogen 3.062 N/A GLN 95.A N ILE 109.A O no hydrogen 2.816 N/A GLN 95.A NE2 GLY 9.A O no hydrogen 3.613 N/A THR 96.A OG1 GLN 108.A OE1 no hydrogen 3.025 N/A ILE 97.A N VAL 107.A O no hydrogen 2.977 N/A ARG 98.A N VAL 107.A O no hydrogen 3.476 N/A ARG 98.A NE LEU 47.A O no hydrogen 3.375 N/A ARG 98.A NE ILE 97.A O no hydrogen 3.010 N/A ARG 98.A NH2 LEU 47.A O no hydrogen 2.810 N/A ARG 98.A NH2 GLU 54.A OE2 no hydrogen 2.729 N/A HIS 99.A N GLU 227.A OE2 no hydrogen 2.886 N/A HIS 99.A ND1 THR 106.A OG1 no hydrogen 2.798 N/A HIS 99.A NE2 SER 223.A OG no hydrogen 2.876 N/A GLU 100.A N PHE 105.A O no hydrogen 2.675 N/A ARG 103.A N GLU 100.A O no hydrogen 2.840 N/A HIS 104.A N PRO 101.A O no hydrogen 3.122 N/A PHE 105.A N GLU 100.A O no hydrogen 3.046 N/A THR 106.A OG1 HIS 99.A ND1 no hydrogen 2.798 N/A THR 106.A OG1 GLN 108.A OE1 no hydrogen 2.802 N/A VAL 107.A N ARG 98.A O no hydrogen 2.627 N/A ILE 109.A N GLN 95.A O no hydrogen 2.743 N/A GLY 110.A N GLU 62.A OE2 no hydrogen 2.636 N/A ASN 111.A N GLU 62.A OE2 no hydrogen 2.662 N/A LEU 114.A N ASN 111.A OD1 no hydrogen 3.172 N/A LEU 115.A N ASN 111.A O no hydrogen 2.964 N/A ALA 116.A N PRO 112.A O no hydrogen 2.862 N/A GLU 117.A N ALA 113.A O no hydrogen 2.997 N/A LEU 118.A N LEU 114.A O no hydrogen 2.900 N/A THR 119.A N LEU 115.A O no hydrogen 3.062 N/A THR 119.A OG1 LEU 115.A O no hydrogen 2.653 N/A THR 119.A OG1 ILE 121.A O no hydrogen 3.468 N/A GLY 120.A N ALA 116.A O no hydrogen 2.964 N/A ILE 121.A N THR 119.A OG1 no hydrogen 3.308 N/A VAL 123.A N TYR 346.A O no hydrogen 2.758 N/A VAL 124.A N ILE 90.A O no hydrogen 2.668 N/A ALA 125.A N ALA 344.A O no hydrogen 3.064 N/A ARG 128.A NE GLY 138.A O no hydrogen 2.676 N/A ARG 128.A NH2 GLY 138.A O no hydrogen 3.168 N/A ARG 129.A NE ASP 126.A OD1 no hydrogen 3.186 N/A ARG 129.A NE ASP 126.A OD2 no hydrogen 3.222 N/A ARG 129.A NH2 ASP 126.A OD2 no hydrogen 3.183 N/A VAL 132.A N ARG 128.A O no hydrogen 3.202 N/A ALA 133.A N ARG 129.A O no hydrogen 2.940 N/A ALA 134.A N ARG 130.A O no hydrogen 3.007 N/A ALA 134.A N ASP 131.A O no hydrogen 3.178 N/A GLY 135.A N VAL 132.A O no hydrogen 3.056 N/A GLY 136.A N ASP 131.A O no hydrogen 2.788 N/A GLN 137.A N THR 334.A O no hydrogen 3.121 N/A GLN 137.A NE2 SER 223.A OG no hydrogen 3.011 N/A GLY 138.A N ASP 131.A OD2 no hydrogen 2.854 N/A PHE 145.A N VAL 142.A O no hydrogen 2.866 N/A HIS 146.A N VAL 142.A O no hydrogen 2.927 N/A GLN 147.A N PRO 143.A O no hydrogen 2.998 N/A ALA 148.A N ALA 144.A O no hydrogen 3.257 N/A LEU 149.A N PHE 145.A O no hydrogen 2.906 N/A PHE 150.A N HIS 146.A O no hydrogen 2.802 N/A SER 151.A OG ASP 271.A O no hydrogen 3.124 N/A ARG 152.A N LEU 166.A O no hydrogen 3.350 N/A ARG 152.A NH1 PHE 150.A O no hydrogen 3.439 N/A VAL 154.A N SER 164.A O no hydrogen 2.863 N/A LEU 155.A N LEU 273.A O no hydrogen 2.619 N/A ASN 156.A N ASN 162.A O no hydrogen 2.784 N/A ASN 156.A ND2 ASN 162.A OD1 no hydrogen 3.002 N/A ILE 157.A N CYS 275.A O no hydrogen 2.832 N/A GLY 158.A N PHE 160.A O no hydrogen 3.136 N/A SER 161.A N GLY 172.A O no hydrogen 2.808 N/A SER 161.A OG PRO 173.A O no hydrogen 3.086 N/A ASN 162.A N ASN 156.A O no hydrogen 2.935 N/A VAL 163.A N PHE 169.A O no hydrogen 3.133 N/A SER 164.A N VAL 154.A O no hydrogen 2.718 N/A LEU 165.A N ARG 167.A O no hydrogen 2.906 N/A LEU 166.A N ARG 152.A O no hydrogen 2.714 N/A ARG 167.A NH1 ALA 268.A O no hydrogen 2.847 N/A ASP 170.A N LYS 222.A O no hydrogen 3.209 N/A CYS 171.A N SER 161.A O no hydrogen 2.686 N/A CYS 171.A SG SER 264.A OG no hydrogen 3.450 N/A GLY 174.A N GLY 159.A O no hydrogen 2.804 N/A ASN 175.A N GLY 158.A O no hydrogen 2.816 N/A ASN 175.A ND2 ILE 157.A O no hydrogen 3.432 N/A ASN 175.A ND2 GLY 158.A O no hydrogen 2.627 N/A VAL 176.A N GLY 159.A O no hydrogen 2.929 N/A ASP 179.A N ASN 175.A O no hydrogen 2.720 N/A ALA 180.A N VAL 176.A O no hydrogen 2.887 N/A TRP 181.A N LEU 177.A O no hydrogen 2.760 N/A TRP 181.A NE1 ALA 246.A O no hydrogen 3.149 N/A ILE 182.A N MET 178.A O no hydrogen 3.259 N/A HIS 183.A N ASP 179.A O no hydrogen 3.138 N/A HIS 183.A ND1 GLY 187.A O no hydrogen 2.928 N/A HIS 183.A ND1 GLU 188.A O no hydrogen 2.980 N/A HIS 184.A N ALA 180.A O no hydrogen 3.013 N/A GLN 185.A N TRP 181.A O no hydrogen 3.034 N/A ARG 186.A N ILE 182.A O no hydrogen 3.104 N/A GLY 194.A N ASP 191.A O no hydrogen 2.900 N/A ALA 195.A N ARG 192.A O no hydrogen 2.978 N/A TRP 196.A N ASP 191.A OD1 no hydrogen 2.851 N/A ALA 197.A N ASP 191.A OD2 no hydrogen 2.883 N/A ALA 198.A N GLY 194.A O no hydrogen 2.972 N/A SER 199.A N ALA 195.A O no hydrogen 3.205 N/A SER 199.A N TRP 196.A O no hydrogen 3.215 N/A SER 199.A OG TRP 196.A O no hydrogen 2.682 N/A GLY 200.A N ALA 197.A O no hydrogen 3.035 N/A GLN 201.A N ASP 248.A OD1 no hydrogen 3.146 N/A ASN 203.A N THR 252.A OG1 no hydrogen 2.945 N/A LEU 206.A N ASN 203.A OD1 no hydrogen 3.032 N/A LEU 207.A N ASN 203.A O no hydrogen 2.942 N/A ALA 208.A N HIS 204.A O no hydrogen 3.092 N/A SER 209.A N ALA 205.A O no hydrogen 3.184 N/A SER 209.A OG HIS 237.A ND1 no hydrogen 3.001 N/A LEU 210.A N LEU 206.A O no hydrogen 2.908 N/A LEU 211.A N LEU 207.A O no hydrogen 2.894 N/A ALA 212.A N ALA 208.A O no hydrogen 3.220 N/A ASP 213.A N LEU 210.A O no hydrogen 3.222 N/A PHE 215.A N ASP 213.A OD2 no hydrogen 3.230 N/A PHE 216.A N ASP 213.A O no hydrogen 3.199 N/A ALA 217.A N GLU 214.A O no hydrogen 3.381 N/A ALA 218.A N PHE 215.A O no hydrogen 3.354 N/A SER 223.A OG HIS 99.A NE2 no hydrogen 2.876 N/A GLU 227.A N GLU 227.A OE1 no hydrogen 2.822 N/A ARG 228.A N GLY 225.A O no hydrogen 3.031 N/A ASN 230.A ND2 ARG 226.A O no hydrogen 2.691 N/A TRP 233.A N ASN 230.A O no hydrogen 3.195 N/A TRP 233.A N ASN 230.A OD1 no hydrogen 3.083 N/A LEU 234.A N ASN 230.A O no hydrogen 3.224 N/A GLN 235.A N LEU 231.A O no hydrogen 2.956 N/A GLU 236.A N PRO 232.A O no hydrogen 3.314 N/A HIS 237.A N LEU 234.A O no hydrogen 3.028 N/A HIS 237.A ND1 SER 209.A OG no hydrogen 3.001 N/A LEU 238.A N LEU 234.A O no hydrogen 2.850 N/A ALA 239.A N GLN 235.A O no hydrogen 2.986 N/A ASP 248.A N PRO 245.A O no hydrogen 2.807 N/A ILE 249.A N PRO 245.A O no hydrogen 3.160 N/A GLN 250.A N ALA 246.A O no hydrogen 3.041 N/A GLN 250.A NE2 MET 178.A O no hydrogen 3.081 N/A GLN 250.A NE2 ASP 191.A OD2 no hydrogen 3.557 N/A ALA 251.A N ALA 247.A O no hydrogen 2.957 N/A THR 252.A N ASP 248.A O no hydrogen 3.059 N/A THR 252.A OG1 ASP 248.A O no hydrogen 2.635 N/A LEU 253.A N ILE 249.A O no hydrogen 2.910 N/A LEU 254.A N GLN 250.A O no hydrogen 3.049 N/A GLU 255.A N ALA 251.A O no hydrogen 3.146 N/A LEU 256.A N THR 252.A O no hydrogen 2.923 N/A SER 257.A N LEU 253.A O no hydrogen 3.181 N/A SER 257.A OG PRO 173.A O no hydrogen 2.924 N/A SER 257.A OG GLY 174.A O no hydrogen 2.900 N/A ALA 258.A N LEU 254.A O no hydrogen 3.051 N/A ARG 259.A N GLU 255.A O no hydrogen 2.825 N/A ARG 259.A NE GLU 263.A OE2 no hydrogen 3.035 N/A SER 260.A N LEU 256.A O no hydrogen 3.037 N/A SER 260.A OG LEU 256.A O no hydrogen 2.707 N/A SER 260.A OG SER 257.A O no hydrogen 3.372 N/A ILE 261.A N SER 257.A O no hydrogen 3.191 N/A SER 262.A N ALA 258.A O no hydrogen 3.029 N/A SER 262.A OG ALA 258.A O no hydrogen 2.509 N/A GLU 263.A N ARG 259.A O no hydrogen 2.914 N/A SER 264.A N SER 260.A O no hydrogen 3.329 N/A SER 264.A OG SER 260.A O no hydrogen 2.683 N/A SER 264.A OG ILE 261.A O no hydrogen 3.265 N/A LEU 265.A N ILE 261.A O no hydrogen 2.895 N/A LEU 266.A N SER 262.A O no hydrogen 2.763 N/A ASP 267.A N GLU 263.A O no hydrogen 3.024 N/A ALA 268.A N SER 264.A O no hydrogen 3.481 N/A GLN 269.A N LEU 265.A O no hydrogen 2.974 N/A LEU 273.A N ALA 153.A O no hydrogen 2.639 N/A VAL 274.A N ALA 298.A O no hydrogen 2.867 N/A CYS 275.A N LEU 155.A O no hydrogen 2.743 N/A CYS 275.A SG LEU 155.A O no hydrogen 3.626 N/A GLY 276.A N PRO 307.A O no hydrogen 2.775 N/A GLY 278.A N ILE 157.A O no hydrogen 2.882 N/A ALA 279.A N GLY 276.A O no hydrogen 3.113 N/A PHE 280.A N GLY 277.A O no hydrogen 3.205 N/A ASN 281.A N GLY 278.A O no hydrogen 2.997 N/A THR 282.A OG1 ASP 193.A O no hydrogen 3.458 N/A THR 282.A OG1 ASP 193.A OD2 no hydrogen 2.972 N/A ALA 283.A N ASP 193.A O no hydrogen 3.372 N/A LEU 284.A N ASN 281.A OD1 no hydrogen 2.841 N/A MET 285.A N ASN 281.A O no hydrogen 2.884 N/A LYS 286.A N THR 282.A O no hydrogen 2.890 N/A ARG 287.A N ALA 283.A O no hydrogen 3.261 N/A ARG 287.A NE GLU 255.A OE2 no hydrogen 3.504 N/A ARG 287.A NH2 GLU 255.A OE2 no hydrogen 3.460 N/A LEU 288.A N LEU 284.A O no hydrogen 3.035 N/A ALA 289.A N MET 285.A O no hydrogen 3.216 N/A MET 290.A N LYS 286.A O no hydrogen 3.328 N/A MET 292.A N LEU 288.A O no hydrogen 3.155 N/A ARG 296.A NH2 TYR 303.A OH no hydrogen 3.527 N/A ALA 298.A N VAL 272.A O no hydrogen 3.111 N/A THR 300.A N VAL 274.A O no hydrogen 3.014 N/A THR 300.A OG1 ILE 305.A O no hydrogen 2.773 N/A ASP 301.A N SER 299.A OG no hydrogen 3.320 N/A GLU 302.A N SER 299.A O no hydrogen 3.201 N/A TYR 303.A N THR 300.A O no hydrogen 2.974 N/A GLY 304.A N ASP 301.A O no hydrogen 3.249 N/A ILE 305.A N THR 300.A O no hydrogen 3.068 N/A TRP 309.A N PRO 306.A O no hydrogen 3.066 N/A MET 313.A N TRP 309.A O no hydrogen 2.987 N/A ALA 314.A N MET 310.A O no hydrogen 2.936 N/A PHE 315.A N GLU 311.A O no hydrogen 3.127 N/A ALA 316.A N GLY 312.A O no hydrogen 3.058 N/A TRP 317.A N MET 313.A O no hydrogen 2.953 N/A LEU 318.A N ALA 314.A O no hydrogen 2.879 N/A ALA 319.A N PHE 315.A O no hydrogen 3.218 N/A HIS 320.A N ALA 316.A O no hydrogen 3.311 N/A ARG 321.A N TRP 317.A O no hydrogen 2.959 N/A ARG 321.A NE PRO 327.A O no hydrogen 3.193 N/A ARG 321.A NH2 PRO 327.A O no hydrogen 3.084 N/A PHE 322.A N LEU 318.A O no hydrogen 2.913 N/A LEU 323.A N ALA 319.A O no hydrogen 2.970 N/A GLU 324.A N HIS 320.A O no hydrogen 2.927 N/A ARG 325.A N PHE 322.A O no hydrogen 2.951 N/A ARG 325.A NH1 PHE 322.A O no hydrogen 2.792 N/A LEU 326.A N ARG 321.A O no hydrogen 2.763 N/A GLY 328.A N ARG 340.A O no hydrogen 2.931 N/A ASN 329.A ND2 ASP 131.A OD1 no hydrogen 3.085 N/A ASN 329.A ND2 GLY 338.A O no hydrogen 2.915 N/A VAL 333.A N CYS 330.A O no hydrogen 2.840 N/A THR 334.A N CYS 330.A O no hydrogen 3.047 N/A THR 334.A OG1 ASP 131.A OD1 no hydrogen 2.730 N/A THR 334.A OG1 ASP 131.A OD2 no hydrogen 3.217 N/A GLY 335.A N PRO 331.A O no hydrogen 2.607 N/A ALA 336.A N THR 334.A OG1 no hydrogen 3.136 N/A LEU 337.A N ALA 134.A O no hydrogen 2.930 N/A ARG 340.A N ASN 329.A OD1 no hydrogen 2.854 N/A ARG 340.A NH1 PRO 339.A O no hydrogen 2.961 N/A ALA 344.A N ALA 125.A O no hydrogen 2.807 N/A TYR 346.A N VAL 123.A O no hydrogen 2.729 N/A