Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bwx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ALA 21.A O no hydrogen 2.860 N/A ARG 7.A N PHE 19.A O no hydrogen 2.812 N/A ARG 7.A NH1 ASP 6.A O no hydrogen 3.237 N/A TRP 9.A N LEU 17.A O no hydrogen 2.912 N/A TRP 9.A NE1 ASP 82.A O no hydrogen 2.834 N/A THR 10.A N GLN 89.A OE1 no hydrogen 3.074 N/A SER 11.A N LEU 15.A O no hydrogen 2.916 N/A SER 11.A OG ASP 13.A OD1 no hydrogen 2.639 N/A SER 12.A OG GLN 81.A OE1 no hydrogen 2.692 N/A GLY 14.A N SER 11.A O no hydrogen 2.944 N/A LEU 15.A N SER 11.A OG no hydrogen 2.919 N/A ARG 16.A N ASP 68.A OD2 no hydrogen 2.953 N/A LEU 17.A N TRP 9.A O no hydrogen 2.894 N/A HIS 18.A N SER 67.A OG no hydrogen 2.859 N/A HIS 18.A ND1 GLU 61.A OE1 no hydrogen 2.745 N/A HIS 18.A NE2 ASP 6.A OD1 no hydrogen 2.733 N/A PHE 19.A N ARG 7.A O no hydrogen 2.886 N/A ARG 20.A N CYS 59.A O no hydrogen 3.024 N/A ALA 21.A N GLU 5.A O no hydrogen 2.845 N/A TYR 22.A N VAL 57.A O no hydrogen 2.737 N/A GLY 24.A N GLU 23.A OE1 no hydrogen 3.067 N/A ASP 25.A N GLY 53.A O no hydrogen 2.950 N/A SER 27.A N ASP 25.A OD1 no hydrogen 2.794 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.634 N/A SER 27.A OG ASP 25.A OD2 no hydrogen 3.425 N/A ARG 28.A N ASP 25.A O no hydrogen 3.391 N/A ARG 28.A NH1 ASP 54.A O no hydrogen 3.168 N/A VAL 31.A N ARG 56.A O no hydrogen 2.851 N/A LEU 32.A N VAL 96.A O no hydrogen 2.731 N/A CYS 33.A N LEU 58.A O no hydrogen 2.879 N/A LEU 34.A N ILE 98.A O no hydrogen 2.879 N/A ARG 39.A N GLY 36.A O no hydrogen 2.985 N/A ARG 39.A NH1 ASP 43.A OD2 no hydrogen 2.883 N/A ASN 40.A ND2 ARG 178.A O no hydrogen 2.980 N/A ALA 41.A N GLU 61.A OE2 no hydrogen 2.850 N/A ARG 42.A N ASN 40.A OD1 no hydrogen 2.812 N/A ARG 42.A NE LYS 177.A O no hydrogen 2.911 N/A ARG 42.A NH1 ASP 190.A OD2 no hydrogen 2.920 N/A ARG 42.A NH2 LYS 177.A O no hydrogen 3.125 N/A ARG 42.A NH2 ASP 190.A OD2 no hydrogen 3.039 N/A ASP 43.A N ASN 40.A O no hydrogen 3.088 N/A PHE 44.A N ALA 41.A O no hydrogen 2.946 N/A GLU 45.A N ARG 42.A O no hydrogen 3.056 N/A ALA 48.A N PHE 44.A O no hydrogen 2.839 N/A THR 49.A OG1 ASP 46.A O no hydrogen 2.691 N/A ARG 50.A N ASP 46.A O no hydrogen 3.064 N/A LEU 51.A N LEU 47.A O no hydrogen 3.011 N/A LEU 51.A N ALA 48.A O no hydrogen 3.212 N/A ALA 52.A N ALA 48.A O no hydrogen 2.813 N/A GLY 53.A N GLU 23.A O no hydrogen 2.982 N/A TRP 55.A N LEU 51.A O no hydrogen 2.902 N/A ARG 56.A NE ASP 25.A O no hydrogen 3.493 N/A ARG 56.A NH2 ARG 28.A O no hydrogen 2.844 N/A VAL 57.A N TYR 22.A O no hydrogen 2.956 N/A LEU 58.A N VAL 31.A O no hydrogen 2.809 N/A CYS 59.A N ARG 20.A O no hydrogen 2.837 N/A GLU 61.A N HIS 18.A O no hydrogen 2.910 N/A ARG 62.A NE ASP 82.A OD2 no hydrogen 2.893 N/A ARG 62.A NH1 ASP 13.A OD2 no hydrogen 2.967 N/A ARG 62.A NH1 THR 74.A OG1 no hydrogen 2.998 N/A ARG 62.A NH2 ASP 13.A OD1 no hydrogen 2.849 N/A ARG 62.A NH2 ASP 13.A OD2 no hydrogen 3.521 N/A ARG 62.A NH2 ASP 82.A OD1 no hydrogen 3.015 N/A ARG 62.A NH2 ASP 82.A OD2 no hydrogen 3.123 N/A GLY 63.A N ASP 68.A O no hydrogen 2.981 N/A ARG 64.A NE LEU 37.A O no hydrogen 2.902 N/A ARG 64.A NH1 ARG 62.A O no hydrogen 2.815 N/A ARG 64.A NH1 TYR 79.A OH no hydrogen 2.915 N/A ARG 64.A NH2 LEU 37.A O no hydrogen 2.925 N/A ARG 64.A NH2 TYR 79.A OH no hydrogen 3.245 N/A GLY 65.A N ASP 190.A O no hydrogen 3.095 N/A ASP 66.A N GLU 61.A OE1 no hydrogen 2.837 N/A SER 67.A N ARG 64.A O no hydrogen 3.076 N/A SER 67.A OG GLU 61.A O no hydrogen 2.611 N/A ASP 68.A N ARG 16.A O no hydrogen 2.990 N/A ALA 70.A N TYR 75.A OH no hydrogen 2.852 N/A THR 74.A OG1 ASP 72.A O no hydrogen 2.731 N/A TYR 75.A N PRO 73.A O no hydrogen 3.155 N/A TYR 75.A OH ASP 192.A OD2 no hydrogen 2.571 N/A GLN 78.A NE2 GLN 78.A O no hydrogen 3.396 N/A GLN 78.A NE2 GLN 81.A OE1 no hydrogen 3.036 N/A GLN 78.A NE2 ASP 82.A OD1 no hydrogen 3.052 N/A TYR 79.A N GLN 76.A O no hydrogen 3.148 N/A LEU 80.A N PRO 77.A O no hydrogen 2.952 N/A ASP 82.A N GLN 78.A O no hydrogen 2.882 N/A LEU 83.A N TYR 79.A O no hydrogen 2.901 N/A GLU 84.A N LEU 80.A O no hydrogen 2.895 N/A ALA 85.A N GLN 81.A O no hydrogen 2.937 N/A LEU 86.A N ASP 82.A O no hydrogen 3.003 N/A LEU 87.A N LEU 83.A O no hydrogen 2.915 N/A ALA 88.A N GLU 84.A O no hydrogen 2.918 N/A GLN 89.A N ALA 85.A O no hydrogen 2.898 N/A GLN 89.A NE2 THR 10.A O no hydrogen 2.857 N/A GLU 90.A N LEU 86.A O no hydrogen 2.939 N/A GLY 91.A N ALA 88.A O no hydrogen 3.217 N/A ILE 92.A N LEU 87.A O no hydrogen 2.967 N/A PHE 95.A N ARG 116.A O no hydrogen 3.007 N/A VAL 96.A N PRO 30.A O no hydrogen 2.854 N/A ALA 97.A N ALA 119.A O no hydrogen 3.078 N/A ILE 98.A N LEU 32.A O no hydrogen 2.877 N/A GLY 99.A N VAL 121.A O no hydrogen 2.983 N/A THR 100.A N LEU 34.A O no hydrogen 3.070 N/A SER 101.A N.A ASN 123.A O no hydrogen 3.161 N/A SER 101.A N.B ASN 123.A O no hydrogen 3.153 N/A SER 101.A OG.A HIS 255.A NE2 no hydrogen 2.878 N/A SER 101.A OG.B HIS 255.A NE2 no hydrogen 3.029 N/A GLY 103.A N THR 100.A O no hydrogen 2.850 N/A GLY 104.A N SER 101.A O.A no hydrogen 2.717 N/A GLY 104.A N SER 101.A O.B no hydrogen 2.714 N/A LEU 105.A N SER 101.A O.A no hydrogen 3.085 N/A LEU 105.A N SER 101.A O.B no hydrogen 3.081 N/A LEU 106.A N LEU 102.A O no hydrogen 2.856 N/A THR 107.A N GLY 103.A O no hydrogen 2.982 N/A THR 107.A OG1 GLY 103.A O no hydrogen 2.924 N/A LEU 109.A N LEU 106.A O no hydrogen 2.798 N/A ALA 110.A N THR 107.A O no hydrogen 2.958 N/A ALA 112.A N LEU 109.A O no hydrogen 3.267 N/A ASN 113.A N ALA 110.A O no hydrogen 2.915 N/A ALA 115.A N ASN 113.A OD1 no hydrogen 3.237 N/A ARG 116.A N ASN 113.A O no hydrogen 2.943 N/A ARG 116.A NH1 GLU 84.A OE1 no hydrogen 3.507 N/A ARG 116.A NH1 GLU 84.A OE2 no hydrogen 2.851 N/A ARG 116.A NH1 LEU 109.A O no hydrogen 2.965 N/A ARG 116.A NH2 GLU 84.A OE1 no hydrogen 2.879 N/A ILE 117.A N PRO 114.A O no hydrogen 2.979 N/A ALA 118.A N PHE 95.A O no hydrogen 2.846 N/A ALA 120.A N PRO 220.A O no hydrogen 2.921 N/A VAL 121.A N ALA 97.A O no hydrogen 2.841 N/A LEU 122.A N LEU 222.A O no hydrogen 2.843 N/A ASN 123.A N GLY 99.A O no hydrogen 2.813 N/A ASN 123.A ND2 THR 100.A OG1 no hydrogen 2.935 N/A ASN 123.A ND2 PRO 257.A O no hydrogen 3.009 N/A ASP 124.A N LEU 224.A O no hydrogen 2.783 N/A SER 130.A N ILE 231.A O no hydrogen 2.896 N/A SER 130.A OG ILE 231.A O no hydrogen 3.261 N/A LEU 134.A N SER 130.A O no hydrogen 3.434 N/A GLU 135.A N PRO 131.A O no hydrogen 2.847 N/A ARG 136.A N GLU 132.A O no hydrogen 3.193 N/A ILE 137.A N GLY 133.A O no hydrogen 3.079 N/A ARG 138.A N LEU 134.A O no hydrogen 3.112 N/A GLY 139.A N GLU 135.A O no hydrogen 3.164 N/A TYR 140.A N ARG 136.A O no hydrogen 3.140 N/A TYR 140.A N ILE 137.A O no hydrogen 3.031 N/A VAL 141.A N ILE 137.A O no hydrogen 3.100 N/A GLY 142.A N TYR 191.A OH no hydrogen 2.843 N/A GLN 143.A N TYR 140.A O no hydrogen 3.206 N/A ARG 145.A NH1 GLU 158.A OE1 no hydrogen 3.482 N/A ASN 146.A ND2 GLY 144.A O no hydrogen 3.463 N/A PHE 147.A N ILE 187.A O no hydrogen 2.935 N/A ALA 152.A N THR 149.A O no hydrogen 3.034 N/A ALA 153.A N TRP 150.A O no hydrogen 2.828 N/A ARG 154.A NH1 GLN 157.A OE1 no hydrogen 2.893 N/A ALA 155.A N HIS 151.A O no hydrogen 3.050 N/A LEU 156.A N ALA 152.A O no hydrogen 3.040 N/A GLN 157.A N ALA 153.A O no hydrogen 2.965 N/A GLU 158.A N ARG 154.A O no hydrogen 2.982 N/A SER 159.A N ALA 155.A O no hydrogen 3.357 N/A SER 159.A N LEU 156.A O no hydrogen 3.173 N/A SER 159.A OG LEU 156.A O no hydrogen 3.430 N/A SER 160.A N LEU 156.A O no hydrogen 2.790 N/A GLY 161.A N GLN 157.A O no hydrogen 2.761 N/A VAL 163.A N SER 160.A O no hydrogen 2.814 N/A TYR 164.A N SER 160.A O no hydrogen 3.090 N/A TYR 164.A OH ALA 256.A O no hydrogen 2.599 N/A TRP 167.A N TYR 164.A O no hydrogen 3.410 N/A ASP 168.A N GLN 171.A OE1 no hydrogen 2.824 N/A THR 170.A OG1 ASP 168.A OD1 no hydrogen 2.701 N/A GLN 171.A N ASP 168.A OD1 no hydrogen 3.106 N/A TRP 172.A N ASP 168.A O no hydrogen 3.079 N/A LEU 173.A N ILE 169.A O no hydrogen 2.982 N/A ARG 174.A N THR 170.A O no hydrogen 3.016 N/A TYR 175.A N GLN 171.A O no hydrogen 3.020 N/A ALA 176.A N TRP 172.A O no hydrogen 2.878 N/A LYS 177.A N LEU 173.A O no hydrogen 3.032 N/A ARG 178.A N ARG 174.A O no hydrogen 3.304 N/A ARG 178.A N TYR 175.A O no hydrogen 3.079 N/A ARG 178.A NE GLU 45.A OE2 no hydrogen 2.828 N/A ARG 178.A NH1 ASP 260.A OD2 no hydrogen 2.824 N/A ARG 178.A NH2 GLU 45.A OE2 no hydrogen 3.526 N/A ARG 178.A NH2 ASP 260.A OD2 no hydrogen 2.976 N/A ILE 179.A N ALA 176.A O no hydrogen 3.174 N/A GLY 182.A N ARG 186.A O no hydrogen 2.900 N/A GLY 185.A N GLY 182.A O no hydrogen 3.130 N/A ARG 186.A NE ASN 146.A OD1 no hydrogen 2.652 N/A ARG 186.A NH2 ASN 146.A O no hydrogen 3.090 N/A ARG 186.A NH2 ASN 146.A OD1 no hydrogen 3.200 N/A ILE 187.A N PHE 147.A O no hydrogen 2.766 N/A ALA 188.A N VAL 180.A O no hydrogen 2.995 N/A ASP 190.A N ILE 179.A O no hydrogen 2.986 N/A TYR 191.A N PHE 189.A O no hydrogen 2.992 N/A ASP 192.A N GLY 63.A O no hydrogen 2.761 N/A ILE 194.A N ASP 192.A O no hydrogen 2.965 N/A GLU 196.A N LYS 193.A O no hydrogen 3.060 N/A ALA 200.A N PRO 197.A O no hydrogen 3.201 N/A ALA 204.A N PRO 201.A O no hydrogen 3.100 N/A VAL 208.A N PRO 206.A O no hydrogen 2.922 N/A TRP 210.A NE1 GLU 128.A OE2 no hydrogen 3.085 N/A ASP 214.A N TRP 210.A O no hydrogen 2.784 N/A ALA 215.A N PRO 211.A O no hydrogen 3.109 N/A LEU 216.A N LEU 212.A O no hydrogen 3.181 N/A ALA 217.A N PHE 213.A O no hydrogen 2.780 N/A THR 218.A N ASP 214.A O no hydrogen 3.217 N/A THR 218.A N ALA 215.A O no hydrogen 3.265 N/A THR 218.A OG1 ALA 215.A O no hydrogen 2.714 N/A ARG 219.A N LEU 216.A O no hydrogen 2.984 N/A ARG 219.A NE ILE 117.A O no hydrogen 2.841 N/A ARG 219.A NH2 ILE 117.A O no hydrogen 3.005 N/A LEU 222.A N ALA 120.A O no hydrogen 2.970 N/A VAL 223.A N GLU 246.A O no hydrogen 2.822 N/A LEU 224.A N LEU 122.A O no hydrogen 2.904 N/A ARG 225.A N VAL 248.A O no hydrogen 2.951 N/A ARG 225.A NE LEU 232.A O no hydrogen 2.716 N/A ARG 225.A NH1 GLU 227.A O no hydrogen 2.938 N/A ARG 225.A NH2 GLU 227.A O no hydrogen 3.151 N/A ARG 225.A NH2 SER 229.A O no hydrogen 3.552 N/A ARG 225.A NH2 LEU 232.A O no hydrogen 3.121 N/A GLY 226.A N ASP 124.A OD1 no hydrogen 2.844 N/A GLU 227.A N LEU 250.A O no hydrogen 2.984 N/A THR 228.A N ILE 253.A O no hydrogen 3.002 N/A SER 229.A N GLY 226.A O no hydrogen 2.905 N/A SER 229.A OG ASP 124.A OD1 no hydrogen 3.296 N/A SER 229.A OG ASP 124.A OD2 no hydrogen 2.518 N/A SER 229.A OG LEU 232.A O no hydrogen 3.524 N/A ILE 231.A N SER 229.A OG no hydrogen 3.055 N/A LEU 232.A N SER 229.A OG no hydrogen 3.002 N/A SER 233.A OG THR 236.A OG1 no hydrogen 2.985 N/A THR 236.A N SER 233.A OG no hydrogen 3.006 N/A THR 236.A OG1 GLU 128.A OE1 no hydrogen 2.677 N/A THR 236.A OG1 SER 233.A OG no hydrogen 2.985 N/A ALA 237.A N SER 233.A O no hydrogen 3.053 N/A ALA 238.A N ALA 234.A O no hydrogen 2.923 N/A LYS 239.A N GLN 235.A O.A no hydrogen 3.074 N/A LYS 239.A N GLN 235.A O.B no hydrogen 3.077 N/A SER 241.A N LYS 239.A O no hydrogen 3.225 N/A SER 241.A OG LYS 239.A O no hydrogen 2.569 N/A ARG 242.A NE ASP 214.A OD1 no hydrogen 2.828 N/A ARG 242.A NH1 LYS 239.A O no hydrogen 3.098 N/A ARG 242.A NH2 ASP 214.A OD1 no hydrogen 3.461 N/A ARG 242.A NH2 ASP 214.A OD2 no hydrogen 2.893 N/A VAL 245.A N ARG 242.A O no hydrogen 3.149 N/A GLU 246.A N LEU 221.A O no hydrogen 2.995 N/A VAL 248.A N VAL 223.A O no hydrogen 2.925 N/A LEU 250.A N ARG 225.A O no hydrogen 2.847 N/A ARG 252.A N GLU 227.A OE1 no hydrogen 2.926 N/A ARG 252.A NE ASP 166.A OD2 no hydrogen 2.728 N/A ARG 252.A NH2 ASP 166.A OD1 no hydrogen 2.618 N/A ARG 252.A NH2 ASP 166.A OD2 no hydrogen 3.464 N/A GLY 254.A N VAL 163.A O no hydrogen 2.965 N/A HIS 255.A ND1 ASP 124.A OD2 no hydrogen 2.528 N/A THR 258.A N GLU 261.A OE2 no hydrogen 2.852 N/A THR 258.A OG1 GLU 261.A OE2 no hydrogen 3.004 N/A LEU 259.A N GLU 261.A OE1 no hydrogen 2.942 N/A ASP 260.A N THR 258.A OG1 no hydrogen 3.051 N/A SER 264.A OG GLU 261.A OE1 no hydrogen 2.711 N/A ILE 265.A N GLU 261.A O no hydrogen 2.948 N/A ALA 266.A N PRO 262.A O no hydrogen 2.939 N/A ALA 267.A N GLU 263.A O no hydrogen 2.971 N/A ILE 268.A N SER 264.A O no hydrogen 2.954 N/A GLY 269.A N ILE 265.A O no hydrogen 2.955 N/A ARG 270.A N ALA 266.A O no hydrogen 3.036 N/A ARG 270.A NE GLU 246.A OE2 no hydrogen 2.842 N/A ARG 270.A NH2 GLU 246.A OE2 no hydrogen 2.930 N/A LEU 271.A N ALA 267.A O no hydrogen 3.035 N/A LEU 272.A N ILE 268.A O no hydrogen 2.851 N/A GLU 273.A N GLY 269.A O no hydrogen 3.178 N/A ARG 274.A N LEU 271.A O no hydrogen 2.922 N/A ARG 274.A NH1 LEU 221.A O no hydrogen 3.317 N/A ARG 274.A NH1 GLY 244.A O no hydrogen 3.096 N/A ARG 274.A NH2 GLY 244.A O no hydrogen 2.642 N/A VAL 275.A N LEU 272.A O no hydrogen 3.260 N/A