Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wbv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N VAL 17.A O no hydrogen 3.005 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.617 N/A ARG 7.A NH1 GLU 16.A OE2 no hydrogen 3.246 N/A LEU 10.A N THR 13.A O no hydrogen 2.728 N/A THR 13.A N LEU 10.A O no hydrogen 3.164 N/A THR 13.A OG1 ASN 11.A O no hydrogen 3.114 N/A TRP 15.A N GLN 8.A O no hydrogen 2.714 N/A GLU 16.A N TYR 100.A OH no hydrogen 2.969 N/A VAL 17.A N TYR 6.A O no hydrogen 3.150 N/A GLU 19.A N THR 4.A O no hydrogen 2.939 N/A ARG 20.A NE ASP 40.A OD1 no hydrogen 2.951 N/A ARG 20.A NH2 ASP 40.A OD1 no hydrogen 3.513 N/A ARG 20.A NH2 ASP 40.A OD2 no hydrogen 2.877 N/A TYR 21.A N PRO 18.A O no hydrogen 3.029 N/A TYR 21.A OH ASP 85.A OD2 no hydrogen 2.700 N/A GLN 22.A N PHE 39.A O no hydrogen 2.991 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.724 N/A SER 25.A N ALA 37.A O no hydrogen 2.961 N/A VAL 27.A N VAL 35.A O no hydrogen 2.771 N/A GLY 28.A N VAL 35.A O no hydrogen 3.257 N/A GLY 30.A N GLY 33.A O no hydrogen 2.746 N/A TYR 32.A N LEU 168.A O no hydrogen 3.075 N/A SER 34.A N LYS 51.A O no hydrogen 2.989 N/A VAL 35.A N GLY 28.A O no hydrogen 2.668 N/A CYS 36.A N VAL 49.A O no hydrogen 2.817 N/A ALA 37.A N SER 25.A O no hydrogen 2.836 N/A ALA 38.A N VAL 47.A O no hydrogen 2.925 N/A PHE 39.A N GLN 22.A O no hydrogen 2.836 N/A ASP 40.A N LEU 45.A O no hydrogen 2.916 N/A THR 41.A N ARG 20.A O no hydrogen 2.906 N/A THR 41.A OG1 ARG 20.A O no hydrogen 2.874 N/A LYS 42.A N ASP 40.A OD1 no hydrogen 3.103 N/A THR 43.A N ASP 40.A O no hydrogen 3.310 N/A THR 43.A OG1 ASP 40.A OD2 no hydrogen 2.645 N/A GLY 44.A N ASP 40.A O no hydrogen 2.767 N/A LEU 45.A N THR 43.A OG1 no hydrogen 3.409 N/A VAL 47.A N ALA 38.A O no hydrogen 2.891 N/A ALA 48.A N THR 103.A O no hydrogen 2.781 N/A VAL 49.A N CYS 36.A O no hydrogen 2.809 N/A LYS 50.A N LEU 101.A O no hydrogen 2.745 N/A LYS 50.A NZ GLU 68.A OE1 no hydrogen 3.497 N/A LYS 50.A NZ GLU 68.A OE2 no hydrogen 2.665 N/A LYS 51.A N SER 34.A O no hydrogen 2.864 N/A LYS 51.A NZ ILE 14.A O no hydrogen 2.630 N/A LEU 52.A N VAL 99.A O no hydrogen 3.013 N/A SER 53.A N TYR 32.A O no hydrogen 2.760 N/A SER 53.A OG ALA 31.A O no hydrogen 2.551 N/A HIS 61.A N SER 58.A OG no hydrogen 2.993 N/A ALA 62.A N SER 58.A O no hydrogen 2.880 N/A LYS 63.A N ILE 59.A O no hydrogen 2.896 N/A LYS 63.A NZ GLU 325.A O no hydrogen 2.820 N/A ARG 64.A N ILE 60.A O no hydrogen 3.009 N/A THR 65.A N HIS 61.A O no hydrogen 2.957 N/A THR 65.A OG1 PRO 55.A O no hydrogen 2.834 N/A THR 65.A OG1 HIS 61.A O no hydrogen 3.084 N/A TYR 66.A N ALA 62.A O no hydrogen 3.114 N/A ARG 67.A N LYS 63.A O no hydrogen 2.837 N/A ARG 67.A NE GLU 325.A OE1 no hydrogen 3.387 N/A ARG 67.A NE GLU 325.A OE2 no hydrogen 2.863 N/A ARG 67.A NH2 GLU 325.A OE1 no hydrogen 2.944 N/A GLU 68.A N ARG 64.A O no hydrogen 2.984 N/A LEU 69.A N THR 65.A O no hydrogen 3.135 N/A ARG 70.A N TYR 66.A O no hydrogen 2.864 N/A ARG 70.A NH1 TYR 66.A OH no hydrogen 3.215 N/A ARG 70.A NH1 ASP 321.A O no hydrogen 3.539 N/A ARG 70.A NH2 ASP 321.A O no hydrogen 2.962 N/A LEU 71.A N ARG 67.A O no hydrogen 2.931 N/A LEU 72.A N GLU 68.A O no hydrogen 2.876 N/A LYS 73.A N LEU 69.A O no hydrogen 2.871 N/A LYS 73.A NZ GLU 341.A O no hydrogen 2.778 N/A LYS 73.A NZ GLU 341.A OE1 no hydrogen 2.739 N/A HIS 74.A N ARG 70.A O no hydrogen 3.196 N/A HIS 74.A NE2 ASP 318.A O no hydrogen 2.833 N/A MET 75.A N LEU 71.A O no hydrogen 3.083 N/A LYS 76.A N TYR 137.A OH no hydrogen 2.914 N/A ASN 79.A ND2 LEU 161.A O no hydrogen 3.093 N/A VAL 80.A N HIS 77.A O no hydrogen 3.143 N/A ILE 81.A N ILE 163.A O no hydrogen 2.970 N/A LEU 84.A N VAL 102.A O no hydrogen 2.885 N/A ASP 85.A N VAL 102.A O no hydrogen 3.377 N/A PHE 87.A N TYR 100.A O no hydrogen 3.156 N/A THR 88.A OG1 ASP 98.A O no hydrogen 2.676 N/A ALA 90.A N THR 88.A OG1 no hydrogen 3.288 N/A ARG 91.A N GLU 95.A OE2 no hydrogen 2.718 N/A SER 92.A OG GLU 94.A OE1 no hydrogen 3.471 N/A GLU 95.A N SER 92.A O no hydrogen 3.261 N/A GLU 95.A N SER 92.A OG no hydrogen 3.404 N/A PHE 96.A N LEU 93.A O no hydrogen 3.143 N/A TYR 100.A N PHE 87.A O no hydrogen 3.007 N/A LEU 101.A N LYS 50.A O no hydrogen 2.805 N/A VAL 102.A N ASP 85.A O no hydrogen 2.907 N/A THR 103.A N ALA 48.A O no hydrogen 2.982 N/A THR 103.A OG1 GLY 82.A O no hydrogen 2.760 N/A LEU 105.A N ARG 46.A O no hydrogen 2.970 N/A ASP 109.A N ASN 112.A OD1 no hydrogen 3.013 N/A LEU 110.A N PRO 150.A O no hydrogen 3.336 N/A LEU 110.A N LEU 153.A O no hydrogen 2.913 N/A ASN 112.A N ASP 109.A OD1 no hydrogen 2.927 N/A ILE 113.A N ASP 109.A O no hydrogen 3.206 N/A VAL 114.A N LEU 110.A O no hydrogen 2.879 N/A LYS 115.A N ASN 111.A O no hydrogen 3.155 N/A CYS 116.A N ASN 112.A O no hydrogen 2.946 N/A CYS 116.A N ILE 113.A O no hydrogen 3.266 N/A CYS 116.A SG ASN 112.A O no hydrogen 3.107 N/A GLN 117.A N ILE 113.A O no hydrogen 2.934 N/A THR 120.A N HIS 123.A ND1 no hydrogen 3.221 N/A THR 120.A OG1 HIS 123.A ND1 no hydrogen 3.176 N/A HIS 123.A N THR 120.A OG1 no hydrogen 3.274 N/A VAL 124.A N THR 120.A O no hydrogen 3.149 N/A GLN 125.A N ASP 121.A O no hydrogen 2.932 N/A GLN 125.A NE2 ASP 121.A OD2 no hydrogen 2.944 N/A PHE 126.A N ASP 122.A O no hydrogen 3.136 N/A LEU 127.A N HIS 123.A O no hydrogen 2.903 N/A ILE 128.A N VAL 124.A O no hydrogen 2.877 N/A TYR 129.A N GLN 125.A O no hydrogen 2.888 N/A TYR 129.A OH GLU 314.A OE2 no hydrogen 2.763 N/A GLN 130.A N PHE 126.A O no hydrogen 3.148 N/A GLN 130.A NE2 PHE 126.A O no hydrogen 3.312 N/A GLN 130.A NE2 CYS 159.A O no hydrogen 2.826 N/A ILE 131.A N LEU 127.A O no hydrogen 3.167 N/A LEU 132.A N ILE 128.A O no hydrogen 2.951 N/A ARG 133.A N TYR 129.A O no hydrogen 2.825 N/A ARG 133.A NE ASP 313.A O no hydrogen 2.821 N/A ARG 133.A NH1 GLU 78.A OE1 no hydrogen 3.031 N/A ARG 133.A NH1 ASN 79.A OD1 no hydrogen 2.796 N/A ARG 133.A NH2 GLU 78.A OE1 no hydrogen 3.319 N/A ARG 133.A NH2 ASP 313.A O no hydrogen 3.076 N/A ARG 133.A NH2 ASP 313.A OD1 no hydrogen 3.177 N/A GLY 134.A N GLN 130.A O no hydrogen 3.027 N/A LEU 135.A N ILE 131.A O no hydrogen 2.895 N/A LYS 136.A N LEU 132.A O no hydrogen 2.851 N/A LYS 136.A NZ GLU 314.A O no hydrogen 2.806 N/A TYR 137.A N ARG 133.A O no hydrogen 3.330 N/A TYR 137.A OH HIS 74.A O no hydrogen 3.392 N/A ILE 138.A N GLY 134.A O no hydrogen 2.919 N/A HIS 139.A N LEU 135.A O no hydrogen 2.828 N/A HIS 139.A NE2 ASP 202.A OD2 no hydrogen 2.917 N/A SER 140.A N LYS 136.A O no hydrogen 2.985 N/A SER 140.A OG TYR 137.A O no hydrogen 2.567 N/A ALA 141.A N ILE 138.A O no hydrogen 2.964 N/A ASP 142.A N HIS 139.A O no hydrogen 2.934 N/A ILE 143.A N ILE 138.A O no hydrogen 3.147 N/A HIS 145.A N ASP 202.A OD2 no hydrogen 2.874 N/A HIS 145.A NE2 LEU 164.A O no hydrogen 2.726 N/A ARG 146.A N ASP 202.A OD1 no hydrogen 2.788 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.074 N/A ASN 152.A N LYS 149.A O no hydrogen 2.888 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.915 N/A LEU 153.A N PRO 150.A O no hydrogen 3.223 N/A ALA 154.A N LYS 162.A O no hydrogen 2.907 N/A VAL 155.A N ALA 108.A O no hydrogen 2.901 N/A ASN 156.A N GLU 160.A O no hydrogen 3.029 N/A ASN 156.A ND2 GLU 160.A OE1 no hydrogen 2.755 N/A CYS 159.A N ASN 156.A O no hydrogen 3.018 N/A GLU 160.A N ASN 156.A OD1 no hydrogen 2.880 N/A LEU 161.A N GLN 130.A OE1 no hydrogen 2.856 N/A LYS 162.A N ALA 154.A O no hydrogen 2.949 N/A LYS 162.A NZ GLU 78.A O no hydrogen 3.535 N/A LYS 162.A NZ VAL 80.A O no hydrogen 3.035 N/A ILE 163.A N ASN 79.A O no hydrogen 2.837 N/A LEU 164.A N ASN 152.A O no hydrogen 2.965 N/A PHE 166.A N ASN 152.A OD1 no hydrogen 2.932 N/A GLY 167.A N ASP 165.A OD1 no hydrogen 3.087 N/A HIS 171.A NE2 ASP 147.A OD2 no hydrogen 2.710 N/A MET 176.A N ASP 173.A O no hydrogen 3.187 N/A THR 177.A N ASP 174.A O no hydrogen 2.982 N/A THR 177.A OG1 ASP 173.A O no hydrogen 2.754 N/A THR 177.A OG1 ASP 174.A O no hydrogen 3.209 N/A ARG 183.A N VAL 180.A O no hydrogen 3.139 N/A ARG 183.A NE GLN 228.A OE1 no hydrogen 2.922 N/A ARG 183.A NH1 MET 176.A O no hydrogen 2.795 N/A ARG 183.A NH1 GLY 178.A O no hydrogen 2.756 N/A ARG 183.A NH2 GLY 178.A O no hydrogen 3.125 N/A ARG 183.A NH2 GLY 222.A O no hydrogen 3.059 N/A ARG 183.A NH2 GLN 228.A OE1 no hydrogen 3.058 N/A TRP 184.A N ALA 181.A O no hydrogen 3.364 N/A TRP 184.A NE1 GLY 222.A O no hydrogen 3.061 N/A TYR 185.A OH GLU 212.A OE1 no hydrogen 2.448 N/A TYR 185.A OH GLU 212.A OE2 no hydrogen 3.388 N/A ARG 186.A N ARG 183.A O no hydrogen 3.193 N/A ARG 186.A NH1 ASP 147.A OD1 no hydrogen 3.459 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.809 N/A ILE 190.A N ALA 187.A O no hydrogen 3.128 N/A MET 191.A N ALA 187.A O no hydrogen 2.979 N/A LEU 192.A N PRO 188.A O no hydrogen 3.011 N/A ASN 193.A N ILE 190.A O no hydrogen 3.356 N/A TRP 194.A N GLU 189.A O no hydrogen 2.909 N/A ASN 198.A ND2 THR 200.A OG1 no hydrogen 2.837 N/A THR 200.A OG1 SER 290.A O no hydrogen 3.029 N/A VAL 201.A N ASN 198.A O no hydrogen 3.140 N/A ASP 202.A N GLN 199.A O no hydrogen 3.054 N/A ILE 203.A N THR 200.A O no hydrogen 3.061 N/A TRP 204.A N THR 200.A O no hydrogen 3.220 N/A SER 205.A N VAL 201.A O no hydrogen 3.410 N/A SER 205.A OG TYR 185.A O no hydrogen 2.835 N/A SER 205.A OG VAL 201.A O no hydrogen 3.417 N/A VAL 206.A N ASP 202.A O no hydrogen 3.110 N/A GLY 207.A N ILE 203.A O no hydrogen 2.990 N/A CYS 208.A N TRP 204.A O no hydrogen 3.013 N/A CYS 208.A SG TRP 184.A O no hydrogen 4.033 N/A CYS 208.A SG TRP 204.A O no hydrogen 3.510 N/A ILE 209.A N SER 205.A O no hydrogen 2.879 N/A MET 210.A N VAL 206.A O no hydrogen 2.757 N/A ALA 211.A N GLY 207.A O no hydrogen 2.992 N/A GLU 212.A N CYS 208.A O no hydrogen 3.255 N/A LEU 213.A N ILE 209.A O no hydrogen 2.921 N/A LEU 214.A N MET 210.A O no hydrogen 3.020 N/A THR 215.A N ALA 211.A O no hydrogen 3.051 N/A THR 215.A OG1 ALA 211.A O no hydrogen 3.076 N/A GLY 216.A N GLU 212.A O no hydrogen 2.685 N/A ARG 217.A N THR 215.A OG1 no hydrogen 3.064 N/A GLY 222.A N PHE 220.A O no hydrogen 2.829 N/A THR 223.A N ASP 227.A OD2 no hydrogen 2.812 N/A ILE 226.A N ASP 224.A OD1 no hydrogen 2.907 N/A ASP 227.A N ASP 224.A OD1 no hydrogen 2.963 N/A GLN 228.A N ASP 224.A O no hydrogen 2.911 N/A GLN 228.A NE2 ARG 183.A O no hydrogen 2.841 N/A LEU 229.A N HIS 225.A O no hydrogen 3.026 N/A LYS 230.A N ILE 226.A O no hydrogen 2.939 N/A LEU 231.A N ASP 227.A O no hydrogen 3.052 N/A ILE 232.A N GLN 228.A O no hydrogen 2.977 N/A LEU 233.A N LEU 229.A O no hydrogen 2.894 N/A ARG 234.A N LYS 230.A O no hydrogen 3.108 N/A LEU 235.A N LEU 231.A O no hydrogen 3.381 N/A LEU 235.A N ILE 232.A O no hydrogen 2.993 N/A VAL 236.A N ILE 232.A O no hydrogen 2.961 N/A GLY 237.A N LEU 233.A O no hydrogen 2.799 N/A THR 238.A N MET 262.A O no hydrogen 2.954 N/A THR 238.A OG1 MET 262.A O no hydrogen 3.146 N/A LEU 244.A N GLY 240.A O no hydrogen 3.111 N/A LYS 245.A N ALA 241.A O no hydrogen 2.970 N/A LYS 246.A N LEU 243.A O no hydrogen 2.857 N/A LYS 246.A NZ ASP 289.A OD1 no hydrogen 3.338 N/A LYS 246.A NZ ASP 289.A OD2 no hydrogen 2.654 N/A LYS 246.A NZ ASP 291.A OD2 no hydrogen 2.679 N/A ILE 247.A N LEU 244.A O no hydrogen 2.950 N/A ALA 252.A N SER 249.A OG no hydrogen 3.221 N/A ARG 253.A NH1 ILE 247.A O no hydrogen 3.142 N/A ARG 253.A NH1 SER 248.A O no hydrogen 3.526 N/A ASN 254.A N GLU 250.A O no hydrogen 2.970 N/A TYR 255.A N SER 251.A O no hydrogen 2.841 N/A ILE 256.A N ALA 252.A O no hydrogen 3.253 N/A GLN 257.A N ARG 253.A O no hydrogen 3.311 N/A SER 258.A N TYR 255.A O no hydrogen 2.967 N/A SER 258.A OG TYR 255.A O no hydrogen 2.561 N/A LEU 259.A N ILE 256.A O no hydrogen 3.132 N/A MET 262.A N THR 238.A OG1 no hydrogen 2.841 N/A LYS 264.A NZ MET 265.A O no hydrogen 2.864 N/A LYS 264.A NZ GLU 283.A OE2 no hydrogen 2.828 N/A MET 265.A N LEU 235.A O no hydrogen 2.865 N/A ASN 269.A N ASN 266.A O no hydrogen 3.098 N/A ASN 269.A N ASN 266.A OD1 no hydrogen 3.357 N/A VAL 270.A N PHE 267.A O no hydrogen 3.058 N/A PHE 271.A N PHE 267.A O no hydrogen 2.792 N/A ALA 274.A N PHE 271.A O no hydrogen 3.178 N/A ASN 275.A ND2 ASP 121.A OD2 no hydrogen 3.013 N/A LEU 277.A N ASN 275.A OD1 no hydrogen 2.981 N/A VAL 279.A N ASN 275.A O no hydrogen 3.161 N/A ASP 280.A N PRO 276.A O no hydrogen 2.951 N/A LEU 281.A N LEU 277.A O no hydrogen 3.062 N/A LEU 282.A N ALA 278.A O no hydrogen 2.978 N/A GLU 283.A N VAL 279.A O no hydrogen 3.034 N/A LYS 284.A N ASP 280.A O no hydrogen 3.257 N/A LYS 284.A N LEU 281.A O no hydrogen 2.996 N/A LYS 284.A NZ ASP 280.A OD1 no hydrogen 3.488 N/A LYS 284.A NZ ASP 280.A OD2 no hydrogen 2.745 N/A MET 285.A N LEU 281.A O no hydrogen 2.999 N/A MET 285.A N LEU 282.A O no hydrogen 3.210 N/A LEU 286.A N LEU 282.A O no hydrogen 2.816 N/A ASP 291.A N ASP 289.A OD1 no hydrogen 2.948 N/A LYS 292.A N ASP 289.A O no hydrogen 2.890 N/A LYS 292.A NZ GLU 242.A OE2 no hydrogen 3.051 N/A ARG 293.A N SER 290.A O no hydrogen 3.442 N/A ARG 293.A NE VAL 287.A O no hydrogen 2.692 N/A ARG 293.A NH1 GLU 189.A OE2 no hydrogen 2.791 N/A ARG 293.A NH1 THR 200.A O no hydrogen 3.104 N/A ARG 293.A NH2 GLU 189.A OE1 no hydrogen 2.955 N/A ARG 293.A NH2 GLU 189.A OE2 no hydrogen 3.410 N/A ARG 293.A NH2 VAL 287.A O no hydrogen 3.291 N/A ILE 294.A N LYS 284.A O no hydrogen 3.098 N/A THR 295.A N GLN 298.A OE1 no hydrogen 3.001 N/A GLN 298.A N THR 295.A OG1 no hydrogen 3.266 N/A ALA 299.A N THR 295.A O no hydrogen 2.970 N/A LEU 300.A N ALA 296.A O no hydrogen 2.965 N/A ALA 301.A N GLN 298.A O no hydrogen 3.155 N/A HIS 302.A N ALA 299.A O no hydrogen 2.973 N/A TYR 304.A OH ASP 121.A OD1 no hydrogen 2.662 N/A PHE 305.A N HIS 302.A O no hydrogen 3.073 N/A ALA 306.A N ALA 303.A O no hydrogen 3.097 N/A GLN 307.A NE2 GLN 125.A OE1 no hydrogen 3.158 N/A TYR 308.A N PHE 305.A O no hydrogen 2.856 N/A TYR 308.A OH ASP 122.A OD1 no hydrogen 2.620 N/A HIS 309.A N PHE 305.A O no hydrogen 2.825 N/A ASP 310.A N GLU 314.A OE2 no hydrogen 3.224 N/A ASP 312.A N ASP 310.A OD1 no hydrogen 3.005 N/A ASP 313.A N ASP 310.A O no hydrogen 2.928 N/A ALA 317.A N SER 140.A OG no hydrogen 2.795 N/A GLN 322.A NE2 ASP 142.A O no hydrogen 2.771 N/A SER 323.A N ASP 321.A OD1 no hydrogen 2.939 N/A SER 323.A OG ASP 321.A OD1 no hydrogen 2.775 N/A GLU 325.A N GLN 322.A O no hydrogen 2.939 N/A SER 326.A N SER 323.A O no hydrogen 3.154 N/A ARG 327.A N PHE 324.A O no hydrogen 3.036 N/A LEU 330.A N GLU 333.A OE1 no hydrogen 3.048 N/A TRP 334.A N LEU 330.A O no hydrogen 2.988 N/A LYS 335.A N ILE 331.A O no hydrogen 2.824 N/A LYS 335.A NZ ASN 97.A OD1 no hydrogen 2.897 N/A SER 336.A N ASP 332.A O no hydrogen 3.001 N/A LEU 337.A N GLU 333.A O no hydrogen 3.056 N/A THR 338.A N TRP 334.A O no hydrogen 3.013 N/A THR 338.A OG1 TRP 334.A O no hydrogen 2.814 N/A TYR 339.A N LYS 335.A O no hydrogen 2.910 N/A ASP 340.A N SER 336.A O no hydrogen 3.147 N/A GLU 341.A N LEU 337.A O no hydrogen 3.189 N/A VAL 342.A N THR 338.A O no hydrogen 2.904 N/A ILE 343.A N TYR 339.A O no hydrogen 2.967 N/A SER 344.A N ASP 340.A O no hydrogen 3.136 N/A SER 344.A OG ASP 340.A O no hydrogen 2.773 N/A SER 344.A OG GLU 341.A O no hydrogen 3.348 N/A PHE 345.A N VAL 342.A O no hydrogen 3.238 N/A GLN 352.A N ASP 351.A OD1 no hydrogen 3.069 N/A