Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wb9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ASP 25.A O no hydrogen 2.998 N/A ARG 3.A N GLN 60.A OE1 no hydrogen 3.001 N/A ARG 3.A NE GLU 57.A O no hydrogen 3.298 N/A ARG 3.A NE GLY 58.A O no hydrogen 2.970 N/A ARG 3.A NH2 GLU 57.A O no hydrogen 2.700 N/A VAL 4.A N GLU 27.A O no hydrogen 2.910 N/A ALA 5.A N GLY 61.A O no hydrogen 3.006 N/A VAL 6.A N GLY 30.A O no hydrogen 3.121 N/A VAL 7.A N LEU 63.A O no hydrogen 2.895 N/A GLY 8.A N VAL 32.A O no hydrogen 2.712 N/A TYR 9.A OH GLU 43.A OE2 no hydrogen 3.263 N/A ARG 14.A N GLY 10.A O no hydrogen 2.685 N/A ARG 14.A NE GLU 18.A OE2 no hydrogen 3.456 N/A ARG 14.A NH1 GLU 18.A OE2 no hydrogen 3.370 N/A TYR 15.A N ASN 11.A O no hydrogen 3.092 N/A LEU 17.A N GLY 13.A O no hydrogen 2.779 N/A GLU 18.A N ARG 14.A O no hydrogen 3.341 N/A ALA 19.A N TYR 15.A O no hydrogen 2.898 N/A VAL 20.A N ALA 16.A O no hydrogen 2.985 N/A GLN 21.A N LEU 17.A O no hydrogen 3.021 N/A ALA 22.A N GLU 18.A O no hydrogen 2.948 N/A ALA 23.A N VAL 20.A O no hydrogen 2.975 N/A GLU 27.A N LEU 2.A O no hydrogen 2.872 N/A VAL 29.A N VAL 4.A O no hydrogen 2.809 N/A VAL 31.A N ARG 48.A O no hydrogen 2.780 N/A VAL 32.A N VAL 6.A O no hydrogen 2.792 N/A ARG 33.A N VAL 50.A O no hydrogen 2.943 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.516 N/A LEU 44.A N PRO 41.A O no hydrogen 2.997 N/A THR 45.A N PRO 42.A O no hydrogen 3.119 N/A THR 45.A OG1 PRO 42.A O no hydrogen 2.913 N/A VAL 47.A N LEU 44.A O no hydrogen 2.956 N/A ARG 48.A NE GLN 55.A O no hydrogen 2.941 N/A ARG 48.A NH2 GLN 55.A O no hydrogen 2.891 N/A VAL 50.A N VAL 31.A O no hydrogen 2.939 N/A SER 54.A N ASP 52.A OD2 no hydrogen 2.905 N/A SER 54.A OG ASP 52.A OD2 no hydrogen 2.587 N/A GLN 55.A N ASP 52.A O no hydrogen 2.908 N/A LEU 56.A N ILE 53.A O no hydrogen 2.972 N/A GLN 60.A N ARG 3.A O no hydrogen 2.810 N/A GLY 61.A N ARG 3.A O no hydrogen 3.119 N/A ALA 62.A N HIS 84.A O no hydrogen 2.816 N/A LEU 63.A N ALA 5.A O no hydrogen 3.036 N/A LEU 64.A N VAL 86.A O no hydrogen 2.833 N/A CYS 65.A N VAL 7.A O no hydrogen 2.759 N/A CYS 65.A SG LEU 63.A O no hydrogen 3.814 N/A THR 68.A OG1 ASP 90.A OD1 no hydrogen 3.072 N/A SER 70.A N PRO 67.A O no hydrogen 2.814 N/A VAL 71.A N PRO 67.A O no hydrogen 3.249 N/A VAL 71.A N THR 68.A O no hydrogen 3.184 N/A TYR 74.A N SER 70.A O no hydrogen 3.124 N/A ALA 75.A N VAL 71.A O no hydrogen 2.809 N/A GLU 76.A N PRO 72.A O no hydrogen 3.156 N/A ALA 77.A N GLU 73.A O no hydrogen 2.972 N/A MET 78.A N TYR 74.A O no hydrogen 2.988 N/A LEU 79.A N ALA 75.A O no hydrogen 2.839 N/A ARG 80.A N GLU 76.A O no hydrogen 2.871 N/A ARG 81.A N MET 78.A O no hydrogen 2.987 N/A GLY 82.A N LEU 79.A O no hydrogen 2.760 N/A ILE 83.A N MET 78.A O no hydrogen 3.190 N/A HIS 84.A N GLN 60.A O no hydrogen 3.025 N/A THR 85.A N ALA 112.A O no hydrogen 3.077 N/A VAL 86.A N ALA 62.A O no hydrogen 3.077 N/A ASP 87.A N VAL 114.A O no hydrogen 3.320 N/A TYR 89.A N ASP 87.A OD1 no hydrogen 2.791 N/A ASP 94.A N ILE 91.A O no hydrogen 3.187 N/A LEU 95.A N ILE 91.A O no hydrogen 3.048 N/A LEU 98.A N ASP 94.A O no hydrogen 2.977 N/A ARG 99.A N LEU 95.A O no hydrogen 2.913 N/A ARG 99.A NE GLU 278.A OE1 no hydrogen 3.141 N/A ARG 99.A NE GLU 278.A OE2 no hydrogen 2.908 N/A ARG 99.A NH2 GLU 278.A OE2 no hydrogen 2.895 N/A ARG 100.A N ALA 96.A O no hydrogen 3.233 N/A ARG 100.A NH2 ASP 97.A OD1 no hydrogen 2.843 N/A ARG 101.A N ASP 97.A O no hydrogen 2.979 N/A ARG 101.A NE GLU 76.A OE2 no hydrogen 3.070 N/A ARG 101.A NH2 GLU 73.A OE2 no hydrogen 3.384 N/A ARG 101.A NH2 GLU 76.A OE1 no hydrogen 2.698 N/A LEU 102.A N LEU 98.A O no hydrogen 2.887 N/A ASP 103.A N ARG 99.A O no hydrogen 2.935 N/A ALA 106.A N LEU 102.A O no hydrogen 2.843 N/A ARG 107.A N ASP 103.A O no hydrogen 3.024 N/A ARG 107.A NH1 ASP 103.A OD2 no hydrogen 2.889 N/A GLU 108.A N PRO 104.A O no hydrogen 2.839 N/A HIS 109.A N VAL 105.A O no hydrogen 3.263 N/A HIS 109.A N ALA 106.A O no hydrogen 3.156 N/A HIS 109.A ND1 VAL 105.A O no hydrogen 2.775 N/A GLY 110.A N ARG 107.A O no hydrogen 3.062 N/A ALA 111.A N ALA 106.A O no hydrogen 2.907 N/A ALA 112.A N HIS 84.A ND1 no hydrogen 2.952 N/A ALA 113.A N GLY 272.A O no hydrogen 2.934 N/A VAL 114.A N THR 85.A O no hydrogen 3.014 N/A ILE 115.A N TYR 274.A O no hydrogen 2.936 N/A SER 116.A N ASP 87.A OD1 no hydrogen 2.927 N/A SER 116.A OG TYR 89.A O no hydrogen 2.835 N/A ALA 117.A N ASP 87.A O no hydrogen 2.764 N/A GLY 118.A N PRO 121.A O no hydrogen 2.957 N/A TRP 119.A NE1 ASN 251.A OD1 no hydrogen 2.758 N/A GLY 122.A N SER 125.A OG no hydrogen 2.945 N/A THR 123.A N GLY 118.A O no hydrogen 3.048 N/A THR 123.A OG1 TRP 119.A O no hydrogen 3.484 N/A ASP 124.A N TRP 119.A O no hydrogen 2.730 N/A SER 125.A N GLY 122.A O no hydrogen 3.049 N/A ILE 126.A N GLY 122.A O no hydrogen 3.294 N/A ILE 127.A N THR 123.A O no hydrogen 3.077 N/A ARG 128.A N ASP 124.A O no hydrogen 2.849 N/A ARG 128.A NH1 ASP 120.A OD1 no hydrogen 2.911 N/A ARG 128.A NH2 ASP 120.A OD2 no hydrogen 2.956 N/A ARG 128.A NH2 THR 142.A OG1 no hydrogen 3.181 N/A ALA 129.A N SER 125.A O no hydrogen 2.987 N/A LEU 130.A N ILE 126.A O no hydrogen 2.924 N/A LEU 131.A N ILE 127.A O no hydrogen 2.983 N/A GLU 132.A N ARG 128.A O no hydrogen 2.978 N/A PHE 133.A N ALA 129.A O no hydrogen 3.172 N/A MET 134.A N LEU 130.A O no hydrogen 2.994 N/A ALA 135.A N LEU 131.A O no hydrogen 3.172 N/A TYR 141.A N GLU 230.A O no hydrogen 2.863 N/A ASN 143.A N VAL 228.A O no hydrogen 2.842 N/A ASN 143.A ND2 VAL 228.A O no hydrogen 3.093 N/A PHE 144.A N HIS 177.A NE2 no hydrogen 2.739 N/A GLY 145.A N GLY 226.A O no hydrogen 2.934 N/A GLY 147.A N THR 169.A O no hydrogen 3.289 N/A SER 149.A N SER 167.A O no hydrogen 2.808 N/A SER 149.A OG HIS 152.A ND1 no hydrogen 2.643 N/A HIS 152.A N SER 149.A OG no hydrogen 3.298 N/A HIS 152.A ND1 SER 149.A OG no hydrogen 2.643 N/A SER 153.A N SER 149.A O no hydrogen 2.948 N/A SER 153.A OG SER 149.A O no hydrogen 2.710 N/A VAL 154.A N MET 150.A O no hydrogen 2.854 N/A ALA 155.A N GLY 151.A O no hydrogen 3.166 N/A VAL 156.A N HIS 152.A O no hydrogen 3.252 N/A LYS 157.A N SER 153.A O no hydrogen 3.149 N/A LYS 157.A NZ ASP 164.A OD1 no hydrogen 2.496 N/A ALA 158.A N VAL 154.A O no hydrogen 3.008 N/A ILE 159.A N VAL 156.A O no hydrogen 3.063 N/A VAL 162.A N ILE 159.A O no hydrogen 3.299 N/A ARG 163.A N GLU 184.A O no hydrogen 2.618 N/A ARG 163.A NE GLU 186.A OE1 no hydrogen 3.406 N/A ARG 163.A NH1 GLU 184.A OE2 no hydrogen 2.961 N/A ASP 164.A N GLU 184.A O no hydrogen 3.135 N/A ALA 165.A N ASP 164.A OD1 no hydrogen 2.820 N/A LEU 166.A N TYR 182.A O no hydrogen 3.012 N/A SER 167.A N SER 153.A OG no hydrogen 2.699 N/A MET 168.A N ALA 180.A O no hydrogen 2.808 N/A THR 169.A N GLY 147.A O no hydrogen 2.684 N/A ILE 170.A N LYS 178.A O no hydrogen 2.823 N/A ALA 172.A N VAL 176.A O no hydrogen 2.831 N/A GLY 175.A N ASN 143.A OD1 no hydrogen 2.816 N/A VAL 176.A N GLY 173.A O no hydrogen 2.985 N/A LYS 178.A N ILE 170.A O no hydrogen 2.722 N/A ARG 179.A N GLU 208.A O no hydrogen 2.861 N/A ARG 179.A NE ASP 207.A OD2 no hydrogen 3.155 N/A ARG 179.A NH2 ASP 207.A OD2 no hydrogen 3.255 N/A ALA 180.A N MET 168.A O no hydrogen 2.992 N/A VAL 181.A N ARG 210.A O no hydrogen 2.741 N/A TYR 182.A N LEU 166.A O no hydrogen 3.044 N/A VAL 183.A N THR 212.A O no hydrogen 2.900 N/A GLU 184.A N ASP 164.A O no hydrogen 2.723 N/A GLU 186.A N GLY 161.A O no hydrogen 2.656 N/A ALA 189.A N GLU 186.A O no hydrogen 3.076 N/A GLU 193.A N ASP 190.A OD2 no hydrogen 3.015 N/A VAL 194.A N ASP 190.A O no hydrogen 3.217 N/A GLU 195.A N PHE 191.A O no hydrogen 2.689 N/A ARG 196.A N ALA 192.A O no hydrogen 3.003 N/A ALA 197.A N GLU 193.A O no hydrogen 2.916 N/A ILE 198.A N VAL 194.A O no hydrogen 2.889 N/A LYS 199.A N GLU 195.A O no hydrogen 3.039 N/A THR 200.A N ARG 196.A O no hydrogen 2.960 N/A THR 200.A OG1 ARG 196.A O no hydrogen 3.164 N/A ASP 201.A N ILE 198.A O no hydrogen 2.931 N/A TYR 203.A N ASP 201.A OD2 no hydrogen 3.015 N/A PHE 204.A N ASP 201.A O no hydrogen 2.844 N/A VAL 205.A N ASP 201.A O no hydrogen 2.779 N/A ASP 207.A N PHE 204.A O no hydrogen 2.807 N/A THR 209.A OG1 ASP 207.A O no hydrogen 3.154 N/A ARG 210.A N ARG 179.A O no hydrogen 2.976 N/A THR 212.A N VAL 181.A O no hydrogen 2.761 N/A VAL 214.A N VAL 183.A O no hydrogen 2.985 N/A VAL 217.A N GLU 184.A OE1 no hydrogen 2.908 N/A SER 218.A OG SER 216.A OG no hydrogen 3.099 N/A LEU 220.A N VAL 217.A O no hydrogen 2.783 N/A MET 221.A N SER 218.A O no hydrogen 3.439 N/A GLY 224.A N ASP 222.A OD2 no hydrogen 2.821 N/A HIS 225.A N ILE 249.A O no hydrogen 2.701 N/A GLY 226.A N HIS 225.A ND1 no hydrogen 2.844 N/A VAL 227.A N MET 247.A O no hydrogen 3.073 N/A VAL 228.A N ASN 143.A O no hydrogen 2.892 N/A MET 229.A N PHE 245.A O no hydrogen 2.734 N/A GLU 230.A N TYR 141.A O no hydrogen 2.955 N/A ARG 231.A N PHE 243.A O no hydrogen 3.069 N/A ARG 231.A NE ALA 135.A O no hydrogen 2.872 N/A ARG 231.A NH1 THR 140.A OG1 no hydrogen 2.774 N/A ARG 231.A NH2 ALA 135.A O no hydrogen 2.808 N/A GLY 233.A N GLN 241.A O no hydrogen 2.975 N/A VAL 234.A N LYS 137.A O no hydrogen 2.707 N/A SER 235.A N THR 238.A O no hydrogen 2.896 N/A SER 235.A OG MET 134.A O no hydrogen 2.701 N/A THR 238.A N SER 235.A O no hydrogen 2.884 N/A GLN 241.A N GLY 233.A O no hydrogen 2.800 N/A GLN 241.A NE2 SER 235.A OG no hydrogen 3.027 N/A PHE 243.A N ARG 231.A O no hydrogen 2.929 N/A ARG 244.A NH1 GLU 230.A OE2 no hydrogen 2.763 N/A ARG 244.A NH2 GLU 246.A OE1 no hydrogen 3.110 N/A PHE 245.A N MET 229.A O no hydrogen 2.820 N/A MET 247.A N VAL 227.A O no hydrogen 2.959 N/A ARG 248.A NE GLU 246.A OE2 no hydrogen 2.866 N/A ARG 248.A NH1 GLY 145.A O no hydrogen 2.868 N/A ARG 248.A NH2 GLU 246.A OE2 no hydrogen 2.779 N/A ILE 249.A N HIS 225.A O no hydrogen 2.911 N/A ASN 250.A ND2 TYR 15.A OH no hydrogen 3.168 N/A ASN 251.A N VAL 223.A O no hydrogen 2.947 N/A ALA 253.A N ASN 250.A OD1 no hydrogen 2.907 N/A LEU 254.A N ASN 250.A O no hydrogen 3.055 N/A THR 255.A N ASN 251.A O no hydrogen 3.043 N/A THR 255.A OG1 ASN 251.A O no hydrogen 2.978 N/A THR 255.A OG1 ASN 251.A OD1 no hydrogen 3.357 N/A ALA 256.A N PRO 252.A O no hydrogen 3.006 N/A GLN 257.A N ALA 253.A O no hydrogen 3.167 N/A VAL 258.A N LEU 254.A O no hydrogen 2.873 N/A MET 259.A N THR 255.A O no hydrogen 2.947 N/A VAL 260.A N ALA 256.A O no hydrogen 3.024 N/A ALA 261.A N GLN 257.A O no hydrogen 3.073 N/A ALA 262.A N VAL 258.A O no hydrogen 2.835 N/A LEU 263.A N MET 259.A O no hydrogen 2.874 N/A ARG 264.A N VAL 260.A O no hydrogen 3.046 N/A ARG 264.A NE ASP 25.A OD1 no hydrogen 3.499 N/A ARG 264.A NE ASP 25.A OD2 no hydrogen 2.724 N/A ARG 264.A NH1 TYR 284.A O no hydrogen 2.777 N/A ARG 264.A NH2 ASP 25.A OD1 no hydrogen 2.966 N/A ALA 265.A N ALA 261.A O no hydrogen 3.058 N/A ALA 266.A N ALA 262.A O no hydrogen 2.810 N/A ALA 267.A N LEU 263.A O no hydrogen 3.097 N/A ARG 268.A N ALA 265.A O no hydrogen 2.869 N/A ARG 268.A NH1 ASP 283.A O no hydrogen 2.856 N/A ARG 268.A NH1 LEU 285.A O no hydrogen 2.806 N/A ARG 268.A NH2 LEU 285.A O no hydrogen 3.389 N/A GLN 269.A N ALA 266.A O no hydrogen 3.007 N/A GLN 269.A NE2 ALA 265.A O no hydrogen 3.052 N/A GLN 269.A NE2 ASP 283.A OD2 no hydrogen 2.821 N/A GLY 272.A N ALA 111.A O no hydrogen 3.009 N/A CYS 273.A N ASP 103.A OD1 no hydrogen 2.813 N/A CYS 273.A SG ALA 113.A O no hydrogen 3.684 N/A TYR 274.A N ALA 113.A O no hydrogen 2.740 N/A TYR 274.A OH LYS 270.A O no hydrogen 2.485 N/A THR 275.A N GLU 278.A OE1 no hydrogen 2.777 N/A THR 275.A OG1 GLU 278.A OE1 no hydrogen 2.688 N/A GLU 278.A N THR 275.A O no hydrogen 3.075 N/A ASP 283.A N PRO 280.A O no hydrogen 2.823 N/A TYR 284.A N VAL 281.A O no hydrogen 3.056 N/A TYR 284.A OH MET 276.A O no hydrogen 2.796 N/A LEU 285.A N ILE 282.A O no hydrogen 3.032 N/A ARG 289.A NH2 ASP 283.A OD1 no hydrogen 2.970 N/A TRP 292.A NE1 PRO 286.A O no hydrogen 2.620 N/A ILE 293.A N ARG 289.A O no hydrogen 2.975 N/A ARG 294.A N GLU 290.A O no hydrogen 3.102 N/A LYS 295.A N ALA 291.A O no hydrogen 3.043 N/A LEU 296.A N TRP 292.A O no hydrogen 2.750 N/A VAL 297.A N ILE 293.A O no hydrogen 3.139 N/A