Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1bws_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N ASP 26.A O no hydrogen 3.048 N/A ARG 3.A N ASP 55.A OD2 no hydrogen 2.720 N/A ARG 3.A NH1 GLU 52.A OE1 no hydrogen 3.564 N/A VAL 4.A N GLU 28.A O no hydrogen 2.809 N/A PHE 5.A N GLN 56.A O no hydrogen 2.881 N/A ALA 7.A N TYR 58.A O no hydrogen 2.982 N/A GLY 11.A N GLY 8.A O no hydrogen 3.004 N/A SER 15.A N GLY 11.A O no hydrogen 2.884 N/A SER 15.A OG GLY 11.A O no hydrogen 2.840 N/A SER 15.A OG MET 12.A O no hydrogen 3.140 N/A ALA 16.A N MET 12.A O no hydrogen 3.265 N/A ILE 17.A N VAL 13.A O no hydrogen 3.146 N/A ARG 18.A N GLY 14.A O no hydrogen 2.904 N/A ARG 18.A NE GLU 22.A OE2 no hydrogen 2.565 N/A ARG 19.A N SER 15.A O no hydrogen 3.014 N/A GLN 20.A N ALA 16.A O no hydrogen 3.358 N/A GLN 20.A NE2 ASP 213.A O no hydrogen 3.008 N/A LEU 21.A N ILE 17.A O no hydrogen 2.853 N/A GLU 22.A N ARG 18.A O no hydrogen 2.794 N/A GLN 23.A N GLN 20.A O no hydrogen 3.161 N/A GLN 23.A NE2 ARG 19.A O no hydrogen 3.441 N/A ARG 24.A N LEU 21.A O no hydrogen 2.688 N/A ARG 24.A NH1 GLU 224.A OE2 no hydrogen 3.311 N/A ARG 24.A NH2 GLU 224.A OE1 no hydrogen 2.538 N/A ARG 24.A NH2 GLU 224.A OE2 no hydrogen 3.106 N/A ASP 26.A N ASP 26.A OD1 no hydrogen 2.342 N/A GLU 28.A N GLN 2.A O no hydrogen 2.635 N/A VAL 30.A N VAL 4.A O no hydrogen 2.660 N/A THR 33.A N GLU 36.A OE1 no hydrogen 2.800 N/A THR 33.A OG1 ASP 35.A OD1 no hydrogen 3.374 N/A ASP 35.A N ASP 35.A OD1 no hydrogen 2.488 N/A GLU 36.A N THR 33.A OG1 no hydrogen 3.040 N/A LEU 37.A N THR 33.A O no hydrogen 2.556 N/A ASP 41.A N ASN 38.A O no hydrogen 3.081 N/A SER 42.A OG ASN 87.A OD1 no hydrogen 3.044 N/A ARG 43.A NH1 ASP 47.A OD1 no hydrogen 3.158 N/A ALA 44.A N ASP 41.A OD1 no hydrogen 3.044 N/A VAL 45.A N ASP 41.A O no hydrogen 2.668 N/A HIS 46.A N SER 42.A O no hydrogen 2.565 N/A ASP 47.A N ARG 43.A O no hydrogen 2.738 N/A PHE 48.A N ALA 44.A O no hydrogen 2.994 N/A PHE 49.A N VAL 45.A O no hydrogen 3.110 N/A ALA 50.A N HIS 46.A O no hydrogen 2.712 N/A SER 51.A N PHE 48.A O no hydrogen 3.008 N/A SER 51.A OG ASP 47.A O no hydrogen 3.200 N/A SER 51.A OG PHE 48.A O no hydrogen 3.457 N/A SER 51.A OG GLU 52.A OE2 no hydrogen 3.545 N/A ASP 55.A N ARG 3.A O no hydrogen 2.725 N/A GLN 56.A N ARG 3.A O no hydrogen 3.134 N/A GLN 56.A NE2 GLN 2.A OE1 no hydrogen 3.379 N/A VAL 57.A N LYS 99.A O no hydrogen 3.083 N/A TYR 58.A N PHE 5.A O no hydrogen 2.832 N/A LEU 59.A N LEU 101.A O no hydrogen 2.819 N/A ALA 60.A N TYR 58.A O no hydrogen 3.089 N/A LYS 63.A N ASN 81.A OD1 no hydrogen 3.085 N/A ILE 67.A N SER 176.A OG no hydrogen 2.924 N/A ASN 70.A N GLY 66.A O no hydrogen 2.856 N/A ASN 70.A ND2 GLY 65.A O no hydrogen 3.069 N/A ASN 70.A ND2 GLY 66.A O no hydrogen 2.881 N/A ASN 71.A N ILE 67.A O no hydrogen 3.077 N/A ASN 71.A ND2 ILE 67.A O no hydrogen 3.014 N/A ASN 71.A ND2 THR 130.A OG1 no hydrogen 3.092 N/A THR 72.A N VAL 68.A O no hydrogen 2.900 N/A THR 72.A N ALA 69.A O no hydrogen 2.957 N/A THR 72.A OG1 VAL 68.A O no hydrogen 2.592 N/A TYR 73.A N ALA 69.A O no hydrogen 2.845 N/A PHE 77.A N TYR 73.A O no hydrogen 3.448 N/A ILE 78.A N PRO 74.A O no hydrogen 3.161 N/A TYR 79.A N ALA 75.A O no hydrogen 2.879 N/A GLN 80.A N ASP 76.A O no hydrogen 3.057 N/A ASN 81.A ND2 LYS 63.A O no hydrogen 3.011 N/A ASN 81.A ND2 PHE 77.A O no hydrogen 2.452 N/A MET 82.A N ILE 78.A O no hydrogen 2.876 N/A MET 83.A N TYR 79.A O no hydrogen 2.903 N/A ILE 84.A N GLN 80.A O no hydrogen 2.959 N/A GLU 85.A N ASN 81.A O no hydrogen 3.261 N/A SER 86.A N MET 82.A O no hydrogen 3.007 N/A SER 86.A OG MET 82.A O no hydrogen 2.799 N/A ASN 87.A N MET 83.A O no hydrogen 2.856 N/A ASN 87.A ND2 LEU 39.A O no hydrogen 2.788 N/A ILE 88.A N ILE 84.A O no hydrogen 3.176 N/A ILE 89.A N GLU 85.A O no hydrogen 3.076 N/A HIS 90.A N SER 86.A O no hydrogen 3.008 N/A ALA 91.A N ASN 87.A O no hydrogen 2.979 N/A ALA 92.A N ILE 88.A O no hydrogen 2.929 N/A HIS 93.A N ILE 89.A O no hydrogen 2.980 N/A GLN 94.A N HIS 90.A O no hydrogen 3.026 N/A ASN 95.A N ALA 91.A O no hydrogen 2.990 N/A ASN 95.A N ALA 92.A O no hydrogen 2.992 N/A ASN 95.A ND2 ALA 91.A O no hydrogen 2.969 N/A ASP 96.A N HIS 93.A O no hydrogen 2.736 N/A VAL 97.A N ALA 92.A O no hydrogen 2.816 N/A LYS 99.A NZ ASP 155.A OD2 no hydrogen 3.512 N/A LYS 99.A NZ MET 223.A O no hydrogen 2.810 N/A LEU 100.A N ASP 155.A O no hydrogen 3.211 N/A LEU 101.A N VAL 57.A O no hydrogen 2.797 N/A PHE 102.A N ARG 157.A O no hydrogen 2.708 N/A GLY 104.A N VAL 159.A O no hydrogen 2.726 N/A SER 106.A N PRO 161.A O no hydrogen 2.844 N/A SER 106.A OG PRO 161.A O no hydrogen 3.438 N/A CYS 107.A N SER 105.A OG no hydrogen 3.061 N/A CYS 107.A SG SER 105.A OG no hydrogen 2.851 N/A ILE 108.A N SER 105.A O no hydrogen 3.050 N/A TYR 109.A N SER 106.A O no hydrogen 3.026 N/A TYR 109.A OH ASN 242.A OD1 no hydrogen 2.526 N/A LYS 111.A N THR 126.A O no hydrogen 2.675 N/A ALA 113.A N PRO 110.A O no hydrogen 3.272 N/A LYS 114.A N GLU 121.A OE1 no hydrogen 3.430 N/A MET 117.A N LEU 282.A O no hydrogen 2.812 N/A GLU 119.A N GLU 119.A OE1 no hydrogen 3.040 N/A GLU 121.A N ALA 118.A O no hydrogen 2.942 N/A LEU 122.A N GLU 119.A O no hydrogen 3.272 N/A GLN 124.A N GLU 121.A O no hydrogen 3.102 N/A THR 130.A N GLU 128.A OE2 no hydrogen 3.065 N/A THR 130.A OG1 GLU 128.A OE2 no hydrogen 3.174 N/A ASN 131.A N GLU 128.A O no hydrogen 3.104 N/A GLU 132.A N PRO 129.A O no hydrogen 3.311 N/A ALA 135.A N ASN 131.A O no hydrogen 2.708 N/A ILE 136.A N GLU 132.A O no hydrogen 2.886 N/A ALA 137.A N PRO 133.A O no hydrogen 3.032 N/A LYS 138.A N TYR 134.A O no hydrogen 3.087 N/A LYS 138.A NZ LEU 103.A O no hydrogen 2.868 N/A ILE 139.A N ALA 135.A O no hydrogen 2.808 N/A ALA 140.A N ILE 136.A O no hydrogen 2.907 N/A GLY 141.A N ALA 137.A O no hydrogen 2.924 N/A ILE 142.A N LYS 138.A O no hydrogen 3.041 N/A LYS 143.A N ILE 139.A O no hydrogen 2.948 N/A LYS 143.A NZ GLU 146.A OE1 no hydrogen 2.559 N/A LEU 144.A N ALA 140.A O no hydrogen 2.900 N/A CYS 145.A N GLY 141.A O no hydrogen 3.143 N/A CYS 145.A SG GLY 141.A O no hydrogen 3.749 N/A GLU 146.A N ILE 142.A O no hydrogen 2.969 N/A SER 147.A N LYS 143.A O no hydrogen 2.985 N/A SER 147.A OG LYS 143.A O no hydrogen 2.922 N/A TYR 148.A N LEU 144.A O no hydrogen 3.096 N/A TYR 148.A OH HIS 90.A ND1 no hydrogen 3.370 N/A ASN 149.A N CYS 145.A O no hydrogen 3.037 N/A ARG 150.A N GLU 146.A O no hydrogen 2.794 N/A GLN 151.A N SER 147.A O no hydrogen 2.882 N/A TYR 152.A N TYR 148.A O no hydrogen 2.786 N/A ARG 154.A NE HIS 93.A ND1 no hydrogen 3.064 N/A ARG 154.A NH1 ASP 96.A OD1 no hydrogen 3.064 N/A ARG 154.A NH1 ASN 98.A OD1 no hydrogen 2.564 N/A ARG 154.A NH2 HIS 93.A ND1 no hydrogen 3.486 N/A ARG 154.A NH2 HIS 93.A O no hydrogen 3.272 N/A ARG 154.A NH2 ASP 96.A OD1 no hydrogen 2.677 N/A ASP 155.A N ASN 98.A O no hydrogen 2.716 N/A TYR 156.A OH VAL 97.A O no hydrogen 2.793 N/A ARG 157.A N LEU 100.A O no hydrogen 2.736 N/A ARG 157.A NE ASP 155.A OD1 no hydrogen 2.606 N/A ARG 157.A NH1 VAL 222.A O no hydrogen 3.139 N/A ARG 157.A NH1 LEU 225.A O no hydrogen 2.607 N/A ARG 157.A NH2 LEU 225.A O no hydrogen 3.139 N/A ARG 157.A NH2 HIS 227.A ND1 no hydrogen 3.400 N/A VAL 159.A N PHE 102.A O no hydrogen 2.990 N/A MET 160.A N ILE 241.A O no hydrogen 3.000 N/A THR 162.A N VAL 243.A O no hydrogen 2.911 N/A THR 162.A OG1 GLU 208.A O no hydrogen 3.427 N/A THR 162.A OG1 GLU 208.A OE1 no hydrogen 2.948 N/A ASN 163.A N THR 162.A OG1 no hydrogen 2.705 N/A ASN 163.A ND2 GLU 208.A O no hydrogen 2.360 N/A TYR 165.A N LEU 210.A O no hydrogen 3.075 N/A ASP 169.A N GLY 166.A O no hydrogen 3.217 N/A ASN 170.A N ASP 169.A OD1 no hydrogen 2.794 N/A HIS 172.A N ASN 170.A O no hydrogen 2.948 N/A ASN 175.A N HIS 172.A O no hydrogen 2.922 N/A ASN 175.A ND2 ASN 170.A O no hydrogen 2.706 N/A HIS 177.A N ASN 175.A OD1 no hydrogen 2.970 N/A ALA 181.A N HIS 177.A O no hydrogen 2.820 N/A LEU 182.A N VAL 178.A O no hydrogen 2.574 N/A LEU 183.A N ILE 179.A O no hydrogen 2.586 N/A ARG 184.A N PRO 180.A O no hydrogen 2.986 N/A ARG 185.A N ALA 181.A O no hydrogen 2.889 N/A ARG 185.A NH1 VAL 198.A O no hydrogen 3.298 N/A ARG 185.A NH2 VAL 198.A O no hydrogen 3.091 N/A PHE 186.A N LEU 182.A O no hydrogen 2.969 N/A HIS 187.A N LEU 183.A O no hydrogen 3.081 N/A HIS 187.A ND1 TYR 307.A OH no hydrogen 2.752 N/A GLU 188.A N ARG 184.A O no hydrogen 3.088 N/A ALA 189.A N ARG 185.A O no hydrogen 2.949 N/A THR 190.A N PHE 186.A O no hydrogen 2.806 N/A THR 190.A OG1 PHE 186.A O no hydrogen 2.645 N/A ALA 191.A N HIS 187.A O no hydrogen 3.052 N/A GLN 192.A N GLU 188.A O no hydrogen 2.855 N/A ASN 193.A N THR 190.A O no hydrogen 3.301 N/A ALA 194.A N ALA 189.A O no hydrogen 3.031 N/A VAL 197.A N ARG 267.A O no hydrogen 3.032 N/A VAL 199.A N VAL 269.A O no hydrogen 2.855 N/A GLY 201.A N ASP 271.A O no hydrogen 2.835 N/A SER 202.A N ASP 276.A OD1 no hydrogen 3.029 N/A SER 202.A OG THR 204.A OG1 no hydrogen 2.560 N/A SER 202.A OG ASP 276.A OD2 no hydrogen 2.748 N/A THR 204.A N SER 202.A OG no hydrogen 2.974 N/A THR 204.A OG1 SER 202.A OG no hydrogen 2.560 N/A MET 206.A N PRO 279.A O no hydrogen 2.685 N/A ARG 207.A N CYS 249.A O no hydrogen 2.894 N/A ARG 207.A NH1 MET 206.A O no hydrogen 2.807 N/A ARG 207.A NH1 THR 278.A O no hydrogen 2.856 N/A ARG 207.A NH2 THR 278.A O no hydrogen 2.688 N/A LEU 210.A N ASN 163.A O no hydrogen 2.729 N/A VAL 212.A N TYR 165.A O no hydrogen 2.793 N/A ASP 213.A N HIS 211.A ND1 no hydrogen 2.834 N/A ASP 214.A N HIS 211.A O no hydrogen 2.941 N/A MET 215.A N HIS 211.A O no hydrogen 3.089 N/A ALA 216.A N VAL 212.A O no hydrogen 2.894 N/A ALA 217.A N ASP 213.A O no hydrogen 3.012 N/A ALA 218.A N ASP 214.A O no hydrogen 2.930 N/A SER 219.A N MET 215.A O no hydrogen 3.060 N/A SER 219.A OG MET 215.A O no hydrogen 3.006 N/A ILE 220.A N ALA 216.A O no hydrogen 3.237 N/A HIS 221.A N ALA 217.A O no hydrogen 3.079 N/A HIS 221.A NE2 LEU 291.A O no hydrogen 2.780 N/A VAL 222.A N ALA 218.A O no hydrogen 2.864 N/A MET 223.A N SER 219.A O no hydrogen 2.657 N/A GLU 224.A N ILE 220.A O no hydrogen 2.929 N/A LEU 225.A N VAL 222.A O no hydrogen 3.457 N/A TRP 230.A N ALA 226.A O no hydrogen 2.896 N/A LEU 231.A N HIS 227.A O no hydrogen 2.752 N/A GLU 232.A N GLU 228.A O no hydrogen 3.133 N/A ASN 233.A N VAL 229.A O no hydrogen 3.139 N/A ASN 233.A N TRP 230.A O no hydrogen 3.082 N/A ASN 233.A ND2 VAL 229.A O no hydrogen 2.426 N/A THR 234.A N LEU 231.A O no hydrogen 2.992 N/A THR 234.A OG1 TRP 230.A O no hydrogen 2.749 N/A THR 234.A OG1 LEU 231.A O no hydrogen 3.510 N/A GLN 235.A N LEU 238.A O no hydrogen 3.292 N/A LEU 238.A N GLN 235.A O no hydrogen 2.925 N/A SER 239.A N GLU 146.A OE2 no hydrogen 2.903 N/A SER 239.A OG GLU 146.A OE2 no hydrogen 2.850 N/A ILE 241.A N SER 158.A O no hydrogen 2.970 N/A ASN 242.A N GLU 119.A OE2 no hydrogen 2.642 N/A ASN 242.A ND2 ASP 284.A O no hydrogen 2.932 N/A VAL 243.A N MET 160.A O no hydrogen 2.676 N/A THR 245.A N GLU 208.A OE2 no hydrogen 2.669 N/A THR 245.A OG1 GLU 208.A OE2 no hydrogen 3.440 N/A THR 245.A OG1 VAL 247.A O no hydrogen 3.560 N/A GLY 246.A N GLU 208.A OE2 no hydrogen 2.684 N/A VAL 247.A N THR 245.A OG1 no hydrogen 3.060 N/A CYS 249.A N ARG 207.A O no hydrogen 3.004 N/A CYS 249.A SG THR 250.A O no hydrogen 3.514 N/A ILE 251.A N PRO 205.A O no hydrogen 3.100 N/A ARG 252.A N GLY 203.A O no hydrogen 3.061 N/A ASP 253.A N THR 250.A OG1 no hydrogen 3.192 N/A LEU 254.A N THR 250.A O no hydrogen 2.955 N/A ALA 255.A N ILE 251.A O no hydrogen 2.738 N/A GLN 256.A N ARG 252.A O no hydrogen 2.924 N/A THR 257.A N ASP 253.A O no hydrogen 2.883 N/A THR 257.A OG1 ASP 253.A O no hydrogen 2.618 N/A ILE 258.A N LEU 254.A O no hydrogen 2.788 N/A ALA 259.A N ALA 255.A O no hydrogen 2.902 N/A LYS 260.A N GLN 256.A O no hydrogen 3.122 N/A VAL 261.A N THR 257.A O no hydrogen 2.839 N/A VAL 262.A N ILE 258.A O no hydrogen 2.861 N/A GLY 263.A N LYS 260.A O no hydrogen 3.314 N/A TYR 264.A N ALA 259.A O no hydrogen 3.087 N/A TYR 264.A OH ALA 194.A O no hydrogen 2.896 N/A ARG 267.A N PRO 195.A O no hydrogen 2.867 N/A VAL 269.A N VAL 197.A O no hydrogen 3.022 N/A ASP 271.A N VAL 199.A O no hydrogen 2.897 N/A SER 273.A N ASP 271.A OD1 no hydrogen 2.619 N/A SER 273.A OG ASP 271.A OD1 no hydrogen 2.527 N/A SER 273.A OG ASP 271.A OD2 no hydrogen 3.259 N/A LYS 274.A N ASP 271.A O no hydrogen 2.888 N/A ARG 280.A NE ASP 248.A OD1 no hydrogen 3.096 N/A ARG 280.A NE ASP 248.A OD2 no hydrogen 2.758 N/A ARG 280.A NH2 ASP 248.A OD2 no hydrogen 3.076 N/A LYS 281.A N MET 206.A O no hydrogen 3.067 N/A LEU 283.A N GLU 208.A OE1 no hydrogen 2.998 N/A ASP 284.A N MET 117.A O no hydrogen 2.883 N/A THR 286.A N ASP 284.A OD1 no hydrogen 2.893 N/A THR 286.A OG1 ASP 284.A OD1 no hydrogen 2.665 N/A ARG 287.A NH1 LEU 238.A O no hydrogen 2.801 N/A ARG 287.A NH1 HIS 240.A O no hydrogen 2.818 N/A ARG 287.A NH2 LEU 238.A O no hydrogen 3.179 N/A HIS 289.A N VAL 285.A O no hydrogen 3.069 N/A HIS 289.A ND1 TRP 293.A O no hydrogen 2.857 N/A GLN 290.A N THR 286.A O no hydrogen 2.846 N/A LEU 291.A N ARG 287.A O no hydrogen 2.963 N/A LEU 291.A N LEU 288.A O no hydrogen 3.021 N/A GLY 292.A N HIS 289.A O no hydrogen 2.834 N/A TRP 293.A N LEU 288.A O no hydrogen 3.145 N/A GLU 296.A N ASP 214.A OD1 no hydrogen 2.856 N/A GLU 296.A N ASP 214.A OD2 no hydrogen 3.204 N/A ILE 297.A N ASP 214.A OD2 no hydrogen 2.972 N/A ALA 301.A N SER 298.A OG no hydrogen 3.056 N/A GLY 302.A N SER 298.A O no hydrogen 2.638 N/A LEU 303.A N LEU 299.A O no hydrogen 2.608 N/A ALA 304.A N GLU 300.A O no hydrogen 3.126 N/A SER 305.A N ALA 301.A O no hydrogen 3.107 N/A SER 305.A OG GLY 302.A O no hydrogen 3.093 N/A THR 306.A N GLY 302.A O no hydrogen 3.032 N/A THR 306.A OG1 GLY 302.A O no hydrogen 2.654 N/A TYR 307.A N LEU 303.A O no hydrogen 2.800 N/A TYR 307.A OH HIS 187.A ND1 no hydrogen 2.752 N/A GLN 308.A N ALA 304.A O no hydrogen 3.315 N/A GLN 308.A NE2 GLU 312.A OE2 no hydrogen 3.287 N/A TRP 309.A N SER 305.A O no hydrogen 3.204 N/A PHE 310.A N THR 306.A O no hydrogen 3.095 N/A LEU 311.A N TYR 307.A O no hydrogen 2.774 N/A GLU 312.A N GLN 308.A O no hydrogen 2.624 N/A ASN 313.A N PHE 310.A O no hydrogen 3.162 N/A