Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wf5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 6.A N ARG 3.A O no hydrogen 2.972 N/A CYS 6.A SG THR 28.A OG1 no hydrogen 3.407 N/A PHE 7.A N PRO 4.A O no hydrogen 3.136 N/A GLU 8.A N ARG 25.A O no hydrogen 2.855 N/A LEU 10.A N GLN 23.A O no hydrogen 2.825 N/A ARG 11.A N GLN 23.A O no hydrogen 3.497 N/A ARG 11.A NE GLN 23.A OE1 no hydrogen 2.826 N/A ARG 11.A NH2 GLN 23.A OE1 no hydrogen 3.386 N/A ARG 11.A NH2 TYR 78.A OH no hydrogen 2.758 N/A LEU 13.A N VAL 21.A O no hydrogen 2.652 N/A GLY 14.A N VAL 21.A O no hydrogen 3.170 N/A GLY 16.A N GLY 19.A O no hydrogen 3.108 N/A GLY 17.A N GLU 146.A O no hydrogen 3.348 N/A LYS 20.A N VAL 40.A O no hydrogen 3.021 N/A VAL 21.A N GLY 14.A O no hydrogen 2.737 N/A PHE 22.A N MET 38.A O no hydrogen 2.795 N/A GLN 23.A N ARG 11.A O no hydrogen 2.835 N/A VAL 24.A N PHE 36.A O no hydrogen 2.851 N/A ARG 25.A N GLU 8.A O no hydrogen 2.950 N/A ARG 25.A NH1 GLU 8.A OE2 no hydrogen 2.262 N/A LYS 26.A N LYS 34.A O no hydrogen 2.820 N/A LYS 26.A NZ THR 28.A O no hydrogen 2.633 N/A VAL 27.A N CYS 6.A O no hydrogen 2.823 N/A ASN 31.A ND2 TYR 64.A OH no hydrogen 3.091 N/A THR 32.A N GLY 29.A O no hydrogen 3.035 N/A THR 32.A OG1 GLY 29.A O no hydrogen 2.526 N/A GLY 33.A N LYS 26.A O no hydrogen 2.635 N/A LYS 34.A N ASN 31.A O no hydrogen 3.002 N/A LYS 34.A NZ ASN 31.A OD1 no hydrogen 2.935 N/A PHE 36.A N VAL 24.A O no hydrogen 2.831 N/A ALA 37.A N LEU 76.A O no hydrogen 2.835 N/A MET 38.A N PHE 22.A O no hydrogen 2.818 N/A LYS 39.A N LEU 74.A O no hydrogen 2.838 N/A LYS 39.A NZ GLU 47.A OE1 no hydrogen 3.459 N/A LYS 39.A NZ GLU 47.A OE2 no hydrogen 2.776 N/A VAL 40.A N LYS 20.A O no hydrogen 2.782 N/A LEU 41.A N LEU 72.A O no hydrogen 2.834 N/A LYS 43.A N GLY 70.A O no hydrogen 2.922 N/A ARG 48.A N THR 44.A O no hydrogen 3.316 N/A ARG 48.A NE GLU 52.A OE2 no hydrogen 2.858 N/A ASN 49.A N LYS 45.A O no hydrogen 3.184 N/A ILE 50.A N ALA 46.A O no hydrogen 2.785 N/A LEU 51.A N GLU 47.A O no hydrogen 2.939 N/A GLU 52.A N ARG 48.A O no hydrogen 2.878 N/A GLU 53.A N ASN 49.A O no hydrogen 2.982 N/A GLU 53.A N ILE 50.A O no hydrogen 3.027 N/A VAL 54.A N ILE 50.A O no hydrogen 3.008 N/A LYS 55.A N HIS 112.A NE2 no hydrogen 3.177 N/A LYS 55.A NZ ASP 61.A OD1 no hydrogen 2.937 N/A PHE 58.A N HIS 56.A ND1 no hydrogen 3.229 N/A ILE 59.A N HIS 56.A O no hydrogen 3.075 N/A VAL 60.A N LEU 138.A O no hydrogen 3.076 N/A ASP 61.A N GLU 77.A OE1 no hydrogen 2.689 N/A ILE 63.A N ILE 75.A O no hydrogen 2.688 N/A TYR 64.A N ILE 75.A O no hydrogen 3.131 N/A PHE 66.A N TYR 73.A O no hydrogen 3.012 N/A THR 68.A N LYS 71.A O no hydrogen 3.145 N/A LYS 71.A N THR 68.A O no hydrogen 3.118 N/A LEU 72.A N LEU 41.A O no hydrogen 2.780 N/A TYR 73.A N PHE 66.A O no hydrogen 2.639 N/A LEU 74.A N LYS 39.A O no hydrogen 2.861 N/A ILE 75.A N TYR 64.A O no hydrogen 2.787 N/A LEU 76.A N ALA 37.A O no hydrogen 2.705 N/A GLU 77.A N ASP 61.A O no hydrogen 3.029 N/A LEU 84.A N ILE 128.A O no hydrogen 2.670 N/A PHE 85.A N PRO 125.A O no hydrogen 3.013 N/A MET 86.A N GLU 83.A O no hydrogen 3.016 N/A GLN 87.A N LEU 84.A O no hydrogen 2.923 N/A GLN 87.A NE2 GLN 277.A OE1 no hydrogen 2.978 N/A LEU 88.A N LEU 84.A O no hydrogen 3.254 N/A GLU 89.A N PHE 85.A O no hydrogen 2.898 N/A ARG 90.A N MET 86.A O no hydrogen 3.079 N/A ARG 90.A NE GLU 91.A OE2 no hydrogen 3.102 N/A ARG 90.A NH1 GLN 87.A OE1 no hydrogen 2.869 N/A ARG 90.A NH2 GLN 87.A OE1 no hydrogen 2.768 N/A ARG 90.A NH2 GLU 91.A OE2 no hydrogen 2.907 N/A GLU 91.A N GLN 87.A O no hydrogen 2.895 N/A GLY 92.A N LEU 88.A O no hydrogen 2.724 N/A ILE 93.A N GLU 91.A O no hydrogen 2.796 N/A PHE 94.A N MET 189.A O no hydrogen 2.878 N/A ALA 99.A N MET 95.A O no hydrogen 2.962 N/A CYS 100.A N GLU 96.A O no hydrogen 2.743 N/A CYS 100.A SG PHE 254.A O no hydrogen 3.495 N/A PHE 101.A N ASP 97.A O no hydrogen 3.142 N/A TYR 102.A N THR 98.A O no hydrogen 3.428 N/A LEU 103.A N ALA 99.A O no hydrogen 2.918 N/A ALA 104.A N CYS 100.A O no hydrogen 2.816 N/A GLU 105.A N PHE 101.A O no hydrogen 3.109 N/A ILE 106.A N TYR 102.A O no hydrogen 2.921 N/A SER 107.A N LEU 103.A O no hydrogen 2.848 N/A SER 107.A OG ALA 104.A O no hydrogen 2.697 N/A MET 108.A N ALA 104.A O no hydrogen 3.279 N/A ALA 109.A N GLU 105.A O no hydrogen 3.187 N/A LEU 110.A N ILE 106.A O no hydrogen 2.840 N/A GLY 111.A N SER 107.A O no hydrogen 2.891 N/A HIS 112.A N MET 108.A O no hydrogen 3.053 N/A LEU 113.A N ALA 109.A O no hydrogen 2.999 N/A HIS 114.A N LEU 110.A O no hydrogen 2.919 N/A HIS 114.A ND1 ASP 245.A OD1 no hydrogen 2.797 N/A HIS 114.A ND1 ASP 245.A OD2 no hydrogen 3.103 N/A HIS 114.A NE2 ASP 178.A OD2 no hydrogen 2.615 N/A GLN 115.A N GLY 111.A O no hydrogen 3.059 N/A LYS 116.A N HIS 112.A O no hydrogen 3.246 N/A LYS 116.A N LEU 113.A O no hydrogen 2.864 N/A GLY 117.A N HIS 114.A O no hydrogen 2.873 N/A ILE 118.A N LEU 113.A O no hydrogen 2.798 N/A TYR 120.A N ASP 178.A OD2 no hydrogen 2.916 N/A TYR 120.A OH ASN 127.A O no hydrogen 2.560 N/A ARG 121.A N ASP 178.A OD1 no hydrogen 2.639 N/A ASP 122.A N TYR 120.A O no hydrogen 2.890 N/A LEU 123.A N SER 181.A OG no hydrogen 2.781 N/A LYS 124.A N ASP 122.A OD1 no hydrogen 3.046 N/A ASN 127.A N LYS 124.A O no hydrogen 2.815 N/A ASN 127.A ND2 ASP 122.A O no hydrogen 3.068 N/A ILE 128.A N PRO 125.A O no hydrogen 3.470 N/A MET 129.A N LYS 137.A O no hydrogen 2.849 N/A LEU 130.A N GLY 82.A O no hydrogen 2.846 N/A ASN 131.A N HIS 135.A O no hydrogen 2.871 N/A ASN 131.A ND2 GLN 133.A OE1 no hydrogen 3.015 N/A GLN 133.A N ASN 131.A OD1 no hydrogen 3.027 N/A GLY 134.A N ASN 131.A O no hydrogen 2.980 N/A HIS 135.A N ASN 131.A OD1 no hydrogen 2.846 N/A HIS 135.A ND1 GLU 105.A OE2 no hydrogen 2.711 N/A VAL 136.A N GLU 105.A OE1 no hydrogen 2.885 N/A LYS 137.A N MET 129.A O no hydrogen 2.774 N/A LYS 137.A NZ PRO 57.A O no hydrogen 3.055 N/A LYS 137.A NZ GLU 77.A OE1 no hydrogen 2.891 N/A LYS 137.A NZ GLU 77.A OE2 no hydrogen 3.560 N/A LEU 138.A N PHE 58.A O no hydrogen 2.897 N/A THR 139.A N TYR 120.A OH no hydrogen 3.223 N/A ASP 140.A N TYR 120.A OH no hydrogen 2.898 N/A LYS 145.A NZ ASN 127.A OD1 no hydrogen 2.689 N/A CYS 157.A SG HIS 149.A ND1 no hydrogen 3.811 N/A CYS 157.A SG ASP 150.A O no hydrogen 3.788 N/A CYS 157.A SG HIS 155.A ND1 no hydrogen 3.447 N/A GLU 161.A N THR 159.A OG1 no hydrogen 3.120 N/A TYR 162.A OH ASP 188.A OD2 no hydrogen 2.533 N/A MET 163.A N ILE 160.A O no hydrogen 3.023 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.801 N/A ILE 167.A N ALA 164.A O no hydrogen 3.013 N/A LEU 168.A N ALA 164.A O no hydrogen 3.245 N/A MET 169.A N PRO 165.A O no hydrogen 2.919 N/A ARG 170.A N ILE 167.A O no hydrogen 3.051 N/A SER 171.A N GLU 166.A O no hydrogen 3.230 N/A SER 171.A OG GLU 166.A O no hydrogen 3.567 N/A ARG 175.A NH1 GLY 240.A O no hydrogen 2.952 N/A ARG 175.A NH1 GLY 242.A O no hydrogen 3.099 N/A ARG 175.A NH1 ASP 245.A OD1 no hydrogen 2.994 N/A ARG 175.A NH2 GLY 242.A O no hydrogen 3.127 N/A ALA 176.A N ASN 174.A OD1 no hydrogen 2.884 N/A VAL 177.A N ASN 174.A O no hydrogen 3.062 N/A ASP 178.A N ARG 175.A O no hydrogen 2.973 N/A TRP 179.A N ALA 176.A O no hydrogen 3.251 N/A TRP 179.A NE1 ASP 245.A OD1 no hydrogen 3.060 N/A TRP 180.A N ALA 176.A O no hydrogen 3.242 N/A SER 181.A N VAL 177.A O no hydrogen 2.996 N/A SER 181.A OG TYR 162.A O no hydrogen 2.729 N/A LEU 182.A N ASP 178.A O no hydrogen 2.866 N/A GLY 183.A N TRP 179.A O no hydrogen 3.139 N/A ALA 184.A N TRP 180.A O no hydrogen 2.998 N/A LEU 185.A N SER 181.A O no hydrogen 2.917 N/A MET 186.A N LEU 182.A O no hydrogen 2.842 N/A TYR 187.A N GLY 183.A O no hydrogen 2.820 N/A TYR 187.A OH ASN 214.A O no hydrogen 2.613 N/A ASP 188.A N ALA 184.A O no hydrogen 2.935 N/A MET 189.A N LEU 185.A O no hydrogen 2.883 N/A LEU 190.A N MET 186.A O no hydrogen 3.009 N/A THR 191.A N TYR 187.A O no hydrogen 2.984 N/A THR 191.A OG1 TYR 187.A O no hydrogen 2.883 N/A GLY 192.A N ASP 188.A O no hydrogen 2.942 N/A GLY 198.A N THR 204.A OG1 no hydrogen 2.919 N/A ARG 201.A NH1 PHE 156.A O no hydrogen 2.974 N/A ARG 201.A NH2 GLY 158.A O no hydrogen 3.050 N/A LYS 203.A N ASN 200.A OD1 no hydrogen 2.774 N/A THR 204.A N ASN 200.A O no hydrogen 2.940 N/A THR 204.A OG1 ASN 200.A O no hydrogen 2.756 N/A ILE 205.A N ARG 201.A O no hydrogen 2.881 N/A ASP 206.A N LYS 202.A O no hydrogen 3.140 N/A LYS 207.A N LYS 203.A O no hydrogen 3.042 N/A LYS 207.A NZ THR 197.A O no hydrogen 2.922 N/A ILE 208.A N THR 204.A O no hydrogen 3.083 N/A LEU 209.A N ILE 205.A O no hydrogen 2.909 N/A LYS 210.A N ASP 206.A O no hydrogen 2.926 N/A CYS 211.A N LYS 207.A O no hydrogen 2.920 N/A CYS 211.A SG LEU 231.A O no hydrogen 3.252 N/A THR 220.A N GLU 96.A OE2 no hydrogen 2.944 N/A THR 220.A OG1 GLU 96.A OE1 no hydrogen 2.752 N/A THR 220.A OG1 GLU 96.A OE2 no hydrogen 3.410 N/A THR 220.A OG1 GLU 222.A OE1 no hydrogen 3.461 N/A GLN 221.A NE2 GLN 221.A O no hydrogen 3.087 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.679 N/A ALA 223.A N THR 220.A OG1 no hydrogen 3.195 N/A ARG 224.A N THR 220.A O no hydrogen 2.970 N/A ASP 225.A N GLN 221.A O no hydrogen 2.844 N/A LEU 226.A N GLU 222.A O no hydrogen 3.062 N/A LEU 227.A N ALA 223.A O no hydrogen 3.043 N/A LYS 228.A N ARG 224.A O no hydrogen 3.009 N/A LYS 229.A N ASP 225.A O no hydrogen 3.095 N/A LYS 229.A N LEU 226.A O no hydrogen 3.065 N/A LYS 229.A NZ ASP 225.A OD1 no hydrogen 3.519 N/A LYS 229.A NZ ASP 225.A OD2 no hydrogen 2.966 N/A LEU 230.A N LEU 227.A O no hydrogen 3.193 N/A LEU 231.A N LEU 227.A O no hydrogen 2.912 N/A LYS 232.A NZ SER 237.A O no hydrogen 2.808 N/A LYS 232.A NZ SER 237.A OG no hydrogen 3.090 N/A ARG 233.A NE LEU 209.A O no hydrogen 3.059 N/A SER 237.A N ASN 234.A O no hydrogen 3.040 N/A SER 237.A OG ASN 234.A O no hydrogen 2.860 N/A ARG 238.A N ALA 235.A O no hydrogen 3.123 N/A ARG 238.A NE LYS 232.A O no hydrogen 2.753 N/A ARG 238.A NH1 GLU 166.A OE2 no hydrogen 2.676 N/A ARG 238.A NH1 ALA 176.A O no hydrogen 3.134 N/A ARG 238.A NH2 GLU 166.A OE1 no hydrogen 2.787 N/A ARG 238.A NH2 GLU 166.A OE2 no hydrogen 3.376 N/A ARG 238.A NH2 LYS 232.A O no hydrogen 2.985 N/A LEU 239.A N LYS 229.A O no hydrogen 2.887 N/A GLY 240.A N GLU 248.A OE1 no hydrogen 3.087 N/A ALA 241.A N ARG 238.A O no hydrogen 3.079 N/A ASP 245.A N GLY 242.A O no hydrogen 3.088 N/A GLU 248.A N GLY 244.A O no hydrogen 3.384 N/A GLU 248.A N ASP 245.A O no hydrogen 3.041 N/A GLN 250.A N ALA 246.A O no hydrogen 2.787 N/A GLN 250.A NE2 SER 107.A OG no hydrogen 3.002 N/A ALA 251.A N GLY 247.A O no hydrogen 3.092 N/A HIS 252.A N VAL 249.A O no hydrogen 3.067 N/A HIS 252.A NE2 ASP 225.A OD2 no hydrogen 2.676 N/A PHE 254.A N HIS 252.A ND1 no hydrogen 2.923 N/A PHE 255.A N HIS 252.A O no hydrogen 2.937 N/A ARG 256.A N PRO 253.A O no hydrogen 3.143 N/A ARG 256.A NH1 PRO 253.A O no hydrogen 2.802 N/A ILE 258.A N PHE 255.A O no hydrogen 2.966 N/A GLU 262.A N ASN 259.A OD1 no hydrogen 3.145 N/A LEU 263.A N ASN 259.A O no hydrogen 2.785 N/A LEU 264.A N TRP 260.A O no hydrogen 2.803 N/A ALA 265.A N GLU 261.A O no hydrogen 3.206 N/A ARG 266.A N LEU 263.A O no hydrogen 2.690 N/A LYS 267.A N GLU 262.A O no hydrogen 2.901 N/A LYS 273.A NZ GLN 133.A O no hydrogen 2.623 N/A LEU 276.A N LYS 273.A O no hydrogen 2.831 N/A GLN 277.A N PRO 274.A O no hydrogen 3.102 N/A GLN 277.A NE2 GLN 87.A OE1 no hydrogen 2.990 N/A